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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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Single/Multi-component
Isotopically Labeled
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Found 252 results

Search term: C20H36O3 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
70260

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-17-19(21)23-20(18)22/h18H,2-17H2,1H3
C20H36O3324.498483900
23177608

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H36O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h9,11,14,17,19,21H,2-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b11-9-,17-14+
C20H36O3324.498202000
13645179

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C20H36O3/c1-3-22-19(23-4-2)7-5-6-8-21-15-20-12-16-9-17(13-20)11-18(10-16)14-20/h16-19H,3-15H2,1-2H3
C20H36O3324.49817800
10150148

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H36O3/c1-2-3-4-5-7-10-13-16-19(21)17-14-11-8-6-9-12-15-18-20(22)23/h7,10,13,16,19,21H,2-6,8-9,11-12,14-15,17-18H2,1H3,(H,22,23)/b10-7-,16-13+
C20H36O3324.498171700
29341689

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H36O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h9,11,14,17,19,21H,2-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b11-9-,17-14+/t19-/m0/s1
C20H36O3324.498161700
4445831

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H36O3/c1-2-3-4-5-7-10-13-16-19(21)17-14-11-8-6-9-12-15-18-20(22)23/h7,10,13,16,19,21H,2-6,8-9,11-12,14-15,17-18H2,1H3,(H,22,23)/b10-7-,16-13+/t19-/m1/s1
C20H36O3324.498040000001131100
169669

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C20H36O3/c1-7-18(4,22)11-8-15-19(5)12-10-16(21)17(2,3)14(19)9-13-20(15,6)23/h7,14-16,21-23H,1,8-13H2,2-6H3/t14-,15+,16-,18-,19-,20+/m0/s1
C20H36O3324.49812800
17220773

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H36O3/c1-2-3-4-5-7-10-13-16-19(21)17-14-11-8-6-9-12-15-18-20(22)23/h7,10,13,16,19,21H,2-6,8-9,11-12,14-15,17-18H2,1H3,(H,22,23)/b10-7-,16-13+/t19-/m0/s1
C20H36O3324.498121000
10618667

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H36O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h9,11,14,17,19,21H,2-8,10,12-13,15-16,18H2,1H3,(H,22,23)/b11-9+,17-14+
C20H36O3324.49812800
22870781

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C20H36O3/c1-17(2)9-6-10-18(3)14(17)7-11-19(4,21)15(18)8-12-20(5,22)16-13-23-16/h14-16,21-22H,6-13H2,1-5H3/t14-,15+,16?,18-,19+,20-/m0/s1
C20H36O3324.49810700
28425573

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C20H36O3/c1-17(2)8-5-6-15-19(4)11-10-18(3,16(22)13-21)12-14(19)7-9-20(15,17)23/h14-16,21-23H,5-13H2,1-4H3/t14-,15+,16?,18-,19-,20-/m1/s1
C20H36O3324.49810500
7994443

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C20H36O3/c1-17(2)9-6-10-18(3)14(17)7-11-19(4,21)15(18)8-12-20(5,22)16-13-23-16/h14-16,21-22H,6-13H2,1-5H3/t14-,15+,16?,18-,19+,20+/m0/s1
C20H36O3324.49810600
8601864

Double-bond stereo
InChI=1/C20H36O3/c21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20(22)23/h8-11,21H,1-7,12-19H2,(H,22,23)/b10-8-,11-9-
C20H36O3324.4989800
291234

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H36O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20(22)18(3)17(2)19(21)23-20/h22H,4-16H2,1-3H3
C20H36O3324.4988700
21615476

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C20H36O3/c1-14(13-17(21)22)7-8-16-19(4)11-6-10-18(2,3)15(19)9-12-20(16,5)23/h14-16,23H,6-13H2,1-5H3,(H,21,22)/t14-,15?,16+,19-,20+/m0/s1
C20H36O3324.4988600
29341676

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H36O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h7,9,18-19H,2-6,8,10-17H2,1H3,(H,21,22)/b9-7-/t18-,19+/m1/s1
C20H36O3324.4987600
35294348

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H36O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6,18-19H,2-3,5,7-17H2,1H3,(H,21,22)/b6-4-/t18-,19+/m0/s1
C20H36O3324.4987400
9361478

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C20H36O3/c1-14(13-17(21)22)7-8-16-19(4)11-6-10-18(2,3)15(19)9-12-20(16,5)23/h14-16,23H,6-13H2,1-5H3,(H,21,22)/t14-,15-,16+,19-,20+/m0/s1
C20H36O3324.4987500
10483388

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C20H36O3/c1-14(13-17(21)22)7-8-16-19(4)11-6-10-18(2,3)15(19)9-12-20(16,5)23/h14-16,23H,6-13H2,1-5H3,(H,21,22)/t14-,15?,16?,19?,20-/m1/s1
C20H36O3324.4986400
4957099

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C20H36O3/c1-2-3-4-5-6-9-12-17-15-16-19(21)18(17)13-10-7-8-11-14-20(22)23/h17-18H,2-16H2,1H3,(H,22,23)/t17-,18+/m0/s1
C20H36O3324.4986700
12345

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