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 4 results

Search term: QWTWAILYRPEELS (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4327145

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C13H22O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h9-12,14H,2-8H2,1H3
C13H22O194.31318332400
5420583

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C13H22O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h9-12,14H,2-8H2,1H3/t9-,10?,11?,12?,13?/m0/s1
C13H22O194.31324200
5420584

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C13H22O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h9-12,14H,2-8H2,1H3/t9-,10?,11?,12?,13?/m1/s1
C13H22O194.31324200
33286883

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C13H22O/c1-9(14)5-13-6-10-2-11(7-13)4-12(3-10)8-13/h9-12,14H,2-8H2,1H3/t9?,10-,11+,12-,13+
C13H22O194.31321100

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