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 20 results

Search term: UCTWMZQNUQWSLP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5611


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1
C9H13NO3183.2044136302462481394
815

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3
C9H13NO3183.204413083423821003
216840

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m1/s1
C9H13NO3183.2044454427387312
23936040

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1D3
C9H10D3NO3186.2229121400
48062857

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1/i1D3
C9H10D3NO3186.222991000
24533154

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i2D,3D,4D,5D2,9D
C9H7D6NO3189.24145800
4925654

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1/i1-1
C811CH13NO3182.20524400
5295195

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/p+1/t9-/m0/s1
C9H14NO3184.212363300
397049

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1-1
C811CH13NO3182.20522200
3316196

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/p+1
C9H14NO3184.21182200
58785198

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1+1D3
C813CH10D3NO3187.21562200
78076115

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m1/s1/i1D3
C9H10D3NO3186.22292200
128932928

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i5+1,9+1,10+1
C713C2H1315NO3186.18312200
111328766

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i4D,9D/hD
C9H10D3NO3186.22291100
111328847

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1D3,5D2
C9H8D5NO3188.23521100
111328848

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1D3,5D2,9D
C9H7D6NO3189.24141100
111328849

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i1D3,2D,3D,4D,5D2,9D
C9H4D9NO3192.25991100
111333952

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i5D2,9D
C9H10D3NO3186.22291100
5295196

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/p+1/t9-/m1/s1
C9H14NO3184.212361100
10571136

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/i3D,4D,9D
C9H10D3NO3186.22291100

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