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: PLHJPQNLCWFPFY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9195824

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9-,10+,11-/m1/s1
C12H20O4228.284881200
4946423

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7-/t9-,10+,11+/m1/s1
C12H20O4228.28486700
10132436

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7-/t9-,10-,11-/m0/s1
C12H20O4228.28485400
9393492

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9-,10+,11+/m1/s1
C12H20O4228.28484400
4944851

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7-/t9-,10+,11-/m1/s1
C12H20O4228.28483400
13095477

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9-,10-,11-/m1/s1
C12H20O4228.28483400
28289544

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9-,10-,11-/m0/s1
C12H20O4228.28483600
13183223

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7-/t9-,10-,11-/m1/s1
C12H20O4228.28482200
74160873

Double-bond stereo

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9-,10+,11-/m0/s1
C12H20O4228.28481100

Advertisement