Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 20 results

Search term: IGEBZMMCKFUABB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9175634

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14-,15-/m1/s1
C15H20O5280.3163232400
113316

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11?,13-,14-,15-/m1/s1
C15H20O5280.31636700
4323406

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3
C15H20O5280.316351800
4983766

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14+,15?/m1/s1
C15H20O5280.316351000
114642051

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11?,13-,14-,15+/m1/s1
C15H20O5280.31635500
8599205

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14+,15-/m1/s1
C15H20O5280.31634300
320506

1 of 6 defined stereocentres - 1/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8?,10?,11?,13-,14?,15?/m1/s1
C15H20O5280.31633200
23174870

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10?,11?,13-,14-,15-/m1/s1
C15H20O5280.31633300
76827142

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11-,13+,14-,15-/m0/s1
C15H20O5280.31633300
103836105

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11-,13-,14-,15-/m1/s1
C15H20O5280.31633300
107446945

6 of 6 defined stereocentres - 6/6 defined

Non-standard isotope
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14-,15-/m1/s1/i2D2
C15H18D2O5282.32862200
77499135

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11-,13?,14-,15-/m0/s1
C15H20O5280.31632200
30816839

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10?,11?,13+,14-,15-/m0/s1
C15H20O5280.31632200
4478509

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10?,11?,13-,14+,15?/m1/s1
C15H20O5280.31632200
9429511

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13?,14-,15-/m1/s1
C15H20O5280.31632100
58840962

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13+,14?,15-/m0/s1
C15H20O5280.31631100
75568301

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10?,11+,13-,14-,15-/m1/s1
C15H20O5280.31631100
23188922

2 of 6 defined stereocentres - 2/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11?,13?,14?,15?/m1/s1
C15H20O5280.31631100
110418044

6 of 6 defined stereocentres - 6/6 defined

Non-standard isotope
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14-,15-/m1/s1/i2+1D2
C1413CH18D2O5283.32131200
129308694

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C15H20O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8,10-11,13H,2,4-7H2,1,3H3/t8-,10+,11+,13-,14?,15-/m1/s1
C15H20O5280.31631100

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