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
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Found 308 results

Search term: C6H9NO5 (Found by molecular formula)
12345
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
58576


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1
C6H9NO5175.13941243066253
88007

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)
C6H9NO5175.139410212210457
487098
InChI=1/C6H9NO5/c1-11-4(8)3-7-5(9)6(10)12-2/h3H2,1-2H3,(H,7,9)
C6H9NO5175.13948312600
3579861

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c1-3-12-6(9)5(4(2)8)7(10)11/h5H,3H2,1-2H3
C6H9NO5175.13936332000
19712029
InChI=1/C6H9NO5/c8-4(1-2-5(9)10)7-3-6(11)12/h1-3H2,(H,7,8)(H,9,10)(H,11,12)
C6H9NO5175.1394302400
388496

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H9NO5/c8-3-7-4(6(11)12)1-2-5(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1
C6H9NO5175.1394282824
10427219

Double-bond stereo
InChI=1/C6H9NO5/c1-3-12-4-5(7(9)10)6(8)11-2/h4H,3H2,1-2H3/b5-4-
C6H9NO5175.1394241500
242582
InChI=1/C6H9NO5/c8-5(1-2-6(9)10)3-4-7(11)12/h1-4H2,(H,9,10)
C6H9NO5175.1394232000
677387

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m1/s1
C6H9NO5175.1394231801
10427220

Double-bond stereo
InChI=1/C6H9NO5/c1-3-12-4-5(7(9)10)6(8)11-2/h4H,3H2,1-2H3/b5-4+
C6H9NO5175.1394191200
802767

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c1-7-6(12-7,4(8)10-2)5(9)11-3/h1-3H3
C6H9NO5175.1394151100
92740

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c8-3-7-4(6(11)12)1-2-5(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
C6H9NO5175.1394131608
389588

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c7-5(6(11)12)3(8)1-2-4(9)10/h5H,1-2,7H2,(H,9,10)(H,11,12)
C6H9NO5175.1394121200
8305707
InChI=1/C6H9NO5/c1-4(8)7(2-5(9)10)3-6(11)12/h2-3H2,1H3,(H,9,10)(H,11,12)
C6H9NO5175.139412900
14809003

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C6H9NO5/c8-4(9)3-1-6(12,2-7-3)5(10)11/h3,7,12H,1-2H2,(H,8,9)(H,10,11)
C6H9NO5175.1394121000
23499684
InChI=1/C6H9NO5/c8-5(9)1-6(2-7(10)11)3-12-4-6/h1-4H2,(H,8,9)
C6H9NO5175.139411800
32820336

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C6H9NO5/c7-3-4(10)5(2(9)1-8)12-6(3)11/h2,5,8-10H,1,7H2/t2-,5+/m0/s1
C6H9NO5175.1394111200
13994224

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C6H9NO5/c8-3-1-2-7-6(3,4(9)10)5(11)12/h3,7-8H,1-2H2,(H,9,10)(H,11,12)
C6H9NO5175.139411900
4954460

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C6H9NO5/c1-2-12-6(11)7-4(3-8)5(9)10/h2,4,8H,1,3H2,(H,7,11)(H,9,10)/t4-/m0/s1
C6H9NO5175.1394111500
9450323
InChI=1/C6H9NO5/c1-12-6(9)3-2-5(8)4-7(10)11/h2-4H2,1H3
C6H9NO5175.139410700
12345

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