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
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Isotopically Labeled
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Found 951 results

Search term: C16H28O (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9032756

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1
C16H28O236.39295876621
4515216

Double-bond stereo
InChI=1/C16H28O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h6,8H,1-5,7,9-15H2/b8-6-
C16H28O236.3929475200
24751283

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H28O/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(17)12-10-15/h13-15H,2-12H2,1H3/t13-,14-
C16H28O236.3929473000
11636356

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H28O/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(17)12-10-15/h13-15H,2-12H2,1H3
C16H28O236.3929322300
4446499

Double-bond stereo
InChI=1/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h4-7,16H,2-3,8-15H2,1H3/b5-4+,7-6+
C16H28O236.39292306440
96437

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3
C16H28O236.3929272500
11231999
InChI=1/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-13-16-14-12-15-17-16/h12,14-15H,2-11,13H2,1H3
C16H28O236.3929252000
5005670

Double-bond stereo
InChI=1/C16H28O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h6,8H,1-5,7,9-15H2/b8-6+
C16H28O236.3929242600
4517798

Double-bond stereo
InChI=1/C16H28O/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-17-5/h8,10,12H,6-7,9,11,13H2,1-5H3/b15-10+,16-12+
C16H28O236.3929242800
79648

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C16H28O/c1-11-6-7-12-14(2,3)13-10-16(11,12)9-8-15(13,4)17-5/h11-13H,6-10H2,1-5H3/t11-,12+,13-,15+,16+/m1/s1
C16H28O236.3929242000
96009

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C16H28O/c1-10-14-8-12(16(10,2)3)9-15(14)11-4-6-13(17)7-5-11/h10-15,17H,4-9H2,1-3H3
C16H28O236.3929231300
4941356

Double-bond stereo
InChI=1/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h3-6,16H,2,7-15H2,1H3/b4-3-,6-5-
C16H28O236.3929222240
24749381

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C16H28O/c1-2-3-4-5-6-16(17)14-8-12-7-13(10-14)11-15(16)9-12/h12-15,17H,2-11H2,1H3
C16H28O236.3929211200
28293585

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C16H28O/c1-11-6-9-16-10-12(11)14(2,3)13(16)7-8-15(16,4)17-5/h11-13H,6-10H2,1-5H3/t11-,12-,13+,15-,16+/m1/s1
C16H28O236.3929201800
9097795

Double-bond stereo
InChI=1/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h4-7,16H,2-3,8-15H2,1H3/b5-4-,7-6+
C16H28O236.3929192600
93057

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C16H28O/c1-10-14-8-12(16(10,2)3)9-15(14)11-5-4-6-13(17)7-11/h10-15,17H,4-9H2,1-3H3
C16H28O236.3929191700
4446500

Double-bond stereo
InChI=1/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h3-6,16H,2,7-15H2,1H3/b4-3+,6-5+
C16H28O236.39292182060
4515219

Double-bond stereo
InChI=1/C16H28O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h1-2H,3-15H2/b2-1-
C16H28O236.3929181700
77396

Double-bond stereo
InChI=1/C16H28O/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-17-5/h8,10,12H,6-7,9,11,13H2,1-5H3
C16H28O236.3929171800
9260942

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C16H28O/c1-11-6-7-12-14(2,3)13-10-16(11,12)9-8-15(13,4)17-5/h11-13H,6-10H2,1-5H3/t11-,12+,13-,15-,16+/m1/s1
C16H28O236.3929171500
12345

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