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 18 results

Search term: MEHHPFQKXOUFFV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23383

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m1/s1
C18H22O2270.366169119181
132075

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17-,18+/m1/s1
C18H22O2270.3661232800
3306758

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3
C18H22O2270.36611210200
23089406

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15?,16?,17-,18-/m0/s1
C18H22O2270.36619600
58784092

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m1/s1/i2D2,3D2,10D
C18H17D5O2275.39695800
58783701

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17-,18+/m1/s1/i2D2,3D2,10D
C18H17D5O2275.39693800
23208930

1 of 4 defined stereocentres - 1/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15?,16?,17-,18?/m0/s1
C18H22O2270.36612200
107448244

3 of 4 defined stereocentres - 3/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16?,17+,18+/m1/s1/i7D2,17D
C18H19D3O2273.38462500
107448284

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m1/s1/i7D2,17D
C18H19D3O2273.38461400
110092709

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m0/s1
C18H22O2270.36611100
111310725

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m0/s1/i2D2,3D2,10D
C18H17D5O2275.39691100
111310784

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m0/s1/i7D2,17D
C18H19D3O2273.38461100
111312200

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16-,17+,18+/m0/s1
C18H22O2270.36611100
114552761

2 of 4 defined stereocentres - 2/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15?,16?,17-,18-/m1/s1
C18H22O2270.36611100
58816298

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18?/m1/s1
C18H22O2270.36611100
95601418

4 of 4 defined stereocentres - 4/4 defined

Non-standard isotope
InChI=1/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3/t15-,16+,17+,18+/m1/s1/i20D
C18H21DO2271.37221100

Advertisement