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 12 results

Search term: LJLMNWPXAYKPGV (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
78359

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)
C13H18N2O218.2948868800
29356692

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12+/m0/s1
C13H18N2O218.2948181500
9260423

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12-/m1/s1
C13H18N2O218.2948151600
9206495

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12-/m0/s1
C13H18N2O218.2948111200
32798059

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12+/m1/s1
C13H18N2O218.2948101700
48062592

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/i4D2,5D2,8D2,9D2,11D,12D
C13H8D10N2O228.35643600
58784752

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/i4D2,5D2,8D2,9D2,11D,12D/hD3
C13H5D13N2O231.37493300
71354302

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12?/m1/s1
C13H18N2O218.29482100
8034958

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11?,12-/m0/s1
C13H18N2O218.29482100
8373818

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11?,12-/m1/s1
C13H18N2O218.29482100
107444240

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12-/m0/s1/i4D2,5D2,8D2,9D2,11D,12D
C13H8D10N2O228.35641400
107444460

2 of 2 defined stereocentres - 2/2 defined

Non-standard isotope
InChI=1/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)/t11-,12+/m1/s1/i4D2,5D2,8D2,9D2,11D,12D
C13H8D10N2O228.35641100

Advertisement