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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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Isotopically Labeled
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Found 58 results

Search term: C9H11BrN2O5 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5813


3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1
C9H11BrN2O5307.0981331562321618
3662399
InChI=1/C9H11BrN2O5/c10-5-6(13)11-4-3-9(16)17-12-7(14)1-2-8(12)15/h1-5H2,(H,11,13)
C9H11BrN2O5307.09804625500
163635

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C9H11BrN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4,6-8,13,15H,3H2,(H,11,14,16)/t4-,6-,7-,8-/m1/s1
C9H11BrN2O5307.098605000
1365436
InChI=1/C9H11BrN2O5/c1-6(13)17-3-2-16-5-12-4-7(10)8(14)11-9(12)15/h4H,2-3,5H2,1H3,(H,11,14,15)
C9H11BrN2O5307.09810500
5532438

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6-,7-/m1/s1
C9H11BrN2O5307.098101000
2011567

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5?,6-,7-/m1/s1
C9H11BrN2O5307.098048500
5294121

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H11BrN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m1/s1
C9H11BrN2O5307.098047300
35154846
InChI=1/C9H11BrN2O5/c10-8-5-7(12(15)16)6-11(9(8)14)1-3-17-4-2-13/h5-6,13H,1-4H2
C9H11BrN2O5307.0987600
10785100

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H11BrN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4,6-8,13,15H,3H2,(H,11,14,16)
C9H11BrN2O5307.0986200
23089673

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H11BrN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4,6-8,13,15H,3H2,(H,11,14,16)/t4-,6+,7?,8-/m1/s1
C9H11BrN2O5307.0986211
23992799

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C9H11BrN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4,6-8,13,15H,3H2,(H,11,14,16)/t4-,6?,7+,8-/m1/s1
C9H11BrN2O5307.0986500
27446655

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-6-2-4(10)7(5(11)3-13)8(9(6)14)12(15)16/h2,5,13-14H,3,11H2,1H3/t5-/m1/s1
C9H11BrN2O5307.0986300
27446656

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-6-2-4(10)7(5(11)3-13)8(9(6)14)12(15)16/h2,5,13-14H,3,11H2,1H3/t5-/m0/s1
C9H11BrN2O5307.0986300
27446657

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-6-2-5(12(15)16)8(10)7(9(6)14)4(11)3-13/h2,4,13-14H,3,11H2,1H3/t4-/m1/s1
C9H11BrN2O5307.0986300
27446658

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-6-2-5(12(15)16)8(10)7(9(6)14)4(11)3-13/h2,4,13-14H,3,11H2,1H3/t4-/m0/s1
C9H11BrN2O5307.0986300
27446659

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-9-7(12(15)16)4(6(11)3-13)2-5(10)8(9)14/h2,6,13-14H,3,11H2,1H3/t6-/m1/s1
C9H11BrN2O5307.0986300
27446660

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C9H11BrN2O5/c1-17-9-7(12(15)16)4(6(11)3-13)2-5(10)8(9)14/h2,6,13-14H,3,11H2,1H3/t6-/m0/s1
C9H11BrN2O5307.0986300
399138

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C9H11BrN2O5/c10-6-1-12(9(15)11-8(6)14)7-4-16-3-5(2-13)17-7/h1,5,7,13H,2-4H2,(H,11,14,15)/t5-,7-/m1/s1
C9H11BrN2O5307.0985500
499875

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C9H11BrN2O5/c10-3-4-6(14)7(15)8(17-4)12-2-1-5(13)11-9(12)16/h1-2,4,6-8,14-15H,3H2,(H,11,13,16)
C9H11BrN2O5307.0985700
8011910

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C9H11BrN2O5/c10-5-2-12(9(16)11-7(5)15)8-6(14)1-4(3-13)17-8/h2,4,6,8,13-14H,1,3H2,(H,11,15,16)/t4-,6+,8+/m0/s1
C9H11BrN2O5307.0985400
123

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