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 17 results

Search term: SGOIRFVFHAKUTI (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
408154

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m1/s1
C9H14N5O4P287.2123135159195037
109442

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1
C9H14N5O4P287.2123614600
58512

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)
C9H14N5O4P287.21235770700
23937211

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/i1D3,2D2,6D
C9H8D6N5O4P293.2493131300
35466906

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m1/s1/i1D3,2D2,6D
C9H8D6N5O4P293.24932100
58785450

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m1/s1/i1D3,2D2
C9H9D5N5O4P292.24312200
58785460

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/i3+1,4+1,7+1,8+1,9+1
C413C5H14N5O4P292.17562400
110404725

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/i1D3,2D2,4D,6D
C9H7D7N5O4P294.25552200
110406111

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/i4+2
C814CH14N5O4P289.20491100
110406399

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/i3T,4T
C9H12T2N5O4P291.22851100
114394547

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1/i3+1,4+1,7+1,8+1,9+1
C413C5H14N5O4P292.17561100
128919793

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/p-1/t6-/m1/s1
C9H13N5O4P286.20491100
76920523

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1/i1D3,2D2
C9H9D5N5O4P292.24311100

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