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: WIQRCHMSJFFONW (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4382

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2
C16H16F3NO295.29956832800
2319851

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/t15-/m0/s1
C16H16F3NO295.2995477100
7973423

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/t15-/m1/s1
C16H16F3NO295.2995373300
48062465

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/t15-/m1/s1/i1D,2D,3D,4D,5D
C16H11D5F3NO300.33049900
48062466

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/t15-/m0/s1/i1D,2D,3D,4D,5D
C16H11D5F3NO300.33046800
57558610

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/i1D,2D,3D,4D,5D
C16H11D5F3NO300.33042200
78334001

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/i10D2,11D2,15D
C16H11D5F3NO300.33041100
95561838

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2/i1D,2D,3D,4D,5D,15D
C16H10D6F3NO301.33651100

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