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trans-N-(2-nitrophenyl)cyclohexane-1,2-diamine
SpectraBase Compound ID 8iy6CgmrcE0
InChI InChI=1S/C12H17N3O2/c13-9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15(16)17/h3-4,7-10,14H,1-2,5-6,13H2/t9-,10-/m0/s1
InChIKey WVLWFAONZQPFMH-UWVGGRQHSA-N
Mol Weight 235.29 g/mol
Molecular Formula C12H17N3O2
Exact Mass 235.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4rnXSRbtM8
Name trans-N-(2-nitrophenyl)cyclohexane-1,2-diamine
Alternate Name(s) (1S,2S)-N1-(2-nitrophenyl)cyclohexane-1,2-diamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N3O2
InChI InChI=1S/C12H17N3O2/c13-9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15(16)17/h3-4,7-10,14H,1-2,5-6,13H2/t9-,10-/m0/s1
InChIKey WVLWFAONZQPFMH-UWVGGRQHSA-N
Literature Reference DOI 10.1002/aoc.966
Molecular Weight 235.287 g/mol
SMILES N[C@@]1([C@](CCCC1)(Nc1c(cccc1)[N+](=O)[O-])[H])[H]
SPLASH splash10-0a59-6900000000-5f000c5d9492ce884625
Source of Spectrum AOC-19-1086-1
Wiley ID 1771025