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 23 results

Search term: RPLCPCMSCLEKRS (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
37400

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1
C22H30O310.4731011409426
3848314

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3
C22H30O310.473760100
21240651

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22+/m0/s1
C22H30O310.4737300
7984191

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17?,18-,19-,20+,21-,22-/m0/s1
C22H30O310.4733200
62623343

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20+,21-,22+/m0/s1
C22H30O310.4733300
62623344

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20+,21-,22-/m0/s1
C22H30O310.4732200
62625944

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20-,21-,22-/m1/s1
C22H30O310.4732200
78220125

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22+/m1/s1
C22H30O310.4732200
8124231

3 of 6 defined stereocentres - 3/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18?,19?,20?,21-,22-/m0/s1
C22H30O310.4732100
21234439

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20-,21-,22-/m0/s1
C22H30O310.4732100
58780712

5 of 6 defined stereocentres - 5/6 defined

Non-standard isotope
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17?,18-,19-,20+,21-,22+/m0/s1/i2+1,5+1,13D2
C2013C2H28D2O314.47062200
62623309

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20+,21-,22-/m1/s1
C22H30O310.4732200
58817425

5 of 6 defined stereocentres - 5/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21?,22-/m0/s1
C22H30O310.4731100
96316893

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19+,20-,21-,22+/m0/s1
C22H30O310.4731200
107449343

6 of 6 defined stereocentres - 6/6 defined

Non-standard isotope
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1/i1D2,2+1,5+1
C2013C2H28D2O314.47061100
110417969

6 of 6 defined stereocentres - 6/6 defined

Non-standard isotope
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20+,21-,22-/m0/s1/i2+1,3D2,5+1
C2013C2H28D2O314.47061100
110804087

4 of 6 defined stereocentres - 4/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19?,20?,21-,22-/m0/s1
C22H30O310.4731100
114391160

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18+,19+,20+,21+,22+/m1/s1
C22H30O310.4731100
114547153

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C22H30O/c1-4-21-14-15(3)20-17-9-7-6-8-16(17)10-11-18(20)19(21)12-13-22(21,23)5-2/h2,8,17-20,23H,3-4,6-7,9-14H2,1H3/t17-,18-,19-,20-,21-,22-/m0/s1
C22H30O310.4731100
12

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