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 9 results

Search term: GSTRJEXEASEEIB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
190186

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)
C10H17NO3199.2469372700
617780

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/t6-,10+/m1/s1
C10H17NO3199.246911900
617783

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/t6-,10-/m0/s1
C10H17NO3199.24693200
617782

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/t6-,10+/m0/s1
C10H17NO3199.24692100
617779

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/t6-,10-/m1/s1
C10H17NO3199.24692100
5299311

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/p-1/t6-,10-/m1/s1
C10H16NO3198.238941100
5299312

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/p-1/t6-,10+/m1/s1
C10H16NO3198.238941100
5299313

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/p-1/t6-,10+/m0/s1
C10H16NO3198.238941100
5299314

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C10H17NO3/c1-9(2)6(7(12)13)4-5-10(9,3)8(11)14/h6H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/p-1/t6-,10-/m0/s1
C10H16NO3198.238941100

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