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 11 results

Search term: DZTHIGRZJZPRDV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1925

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)
C13H14N2O3246.26191521805142
610602

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1
C13H14N2O3246.26191152078448
388950

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m1/s1
C13H14N2O3246.2619997982
4258885

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/p-1
C13H13N2O3245.253924400
5298078

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/p-1/t12-/m0/s1
C13H13N2O3245.253924600
5298079

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/p-1/t12-/m1/s1
C13H13N2O3245.253923300
68897457

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1/i2D,3D,4D,5D,7D
C13H9D5N2O3251.29273200
8507710

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1/i6D,12D/t6-,12-
C13H12D2N2O3248.27422100
8507745

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/i6D,12D,13+1
C1213CH12D2N2O3249.26682100
9207390

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/t12-/m1/s1/i6D,12D/t6-,12-
C13H12D2N2O3248.27422100
95787651

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C13H14N2O3/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18)/p-2
C13H12N2O3244.24711100

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