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 6 results

Search term: OEXPVULGTKWKEH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
137119

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16+/m1/s1
C16H30O3270.40761715540
8598711

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3
C16H30O3270.40766500
9982437

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16-/m0/s1
C16H30O3270.40763202
9996345

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16+/m0/s1
C16H30O3270.40763100
24606933

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16-/m1/s1
C16H30O3270.40762200
28283179

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16?/m0/s1
C16H30O3270.40761100

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