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: JIGCTXHIECXYRJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
552835

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+/t19-,20-/m1/s1
C22H42O2338.5677424101
4933940

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+
C22H42O2338.5677192000
21159875

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3
C22H42O2338.5677131200
65009883

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/t19-,20-/m1/s1
C22H42O2338.56778800
32702169

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16-/t19-,20-/m1/s1
C22H42O2338.56774700
62641878

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+/t19-,20+/m0/s1
C22H42O2338.56772200
64880807

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16-
C22H42O2338.56772200
9188626

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C22H42O2/c1-18(2)10-7-11-19(3)12-8-13-20(4)14-9-15-21(5)16-17-24-22(6)23/h16,18-20H,7-15,17H2,1-6H3/b21-16+/i1+1,3+1,4+1,5+1,7+1,8+1,9+1,17+1
C1413C8H42O2346.50892100

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