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 12 results

Search term: CJJMAWPEZKYJAP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2018184

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)
C11H16O3196.242941097412
21186399

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8+,10+,11-
C11H16O3196.2429251900
589662

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8+,10?,11?
C11H16O3196.24295200
21788040

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8+,10?,11-
C11H16O3196.24293100
57618085

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8?,10?,11?/m1/s1
C11H16O3196.24292100
3357287

Charge

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/p-1
C11H15O3195.2352102
109120560

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7?,8?,10?,11-
C11H16O3196.24292200
110427671

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8+,10+,11+
C11H16O3196.24291100
110550890

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7-,8-,10?,11?/m0/s1
C11H16O3196.24291100
1542197

Charge

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/p-1/t7-,8-,10?,11?/m1/s1
C11H15O3195.23551100
64849324

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C11H16O3/c12-9(13)10-2-7-1-8(3-10)5-11(14,4-7)6-10/h7-8,14H,1-6H2,(H,12,13)/t7?,8?,10-,11+
C11H16O3196.24291100

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