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(+-)-1-.alpha.-Nitro-2.beta.-[3-(6-Chloropyridyl)]cyclohexane-4.beta.-ol
SpectraBase Compound ID FrGPuEsrQya
InChI InChI=1S/C11H13ClN2O3/c12-11-4-1-7(6-13-11)9-5-8(15)2-3-10(9)14(16)17/h1,4,6,8-10,15H,2-3,5H2/t8-,9+,10-/m0/s1
InChIKey ZTVHGTFNXVIDJE-AEJSXWLSSA-N
Mol Weight 256.69 g/mol
Molecular Formula C11H13ClN2O3
Exact Mass 256.06147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lLmSkLLLfo
Name (+-)-1-.alpha.-Nitro-2.beta.-[3-(6-Chloropyridyl)]cyclohexane-4.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13ClN2O3
InChI InChI=1S/C11H13ClN2O3/c12-11-4-1-7(6-13-11)9-5-8(15)2-3-10(9)14(16)17/h1,4,6,8-10,15H,2-3,5H2/t8-,9+,10-/m0/s1
InChIKey ZTVHGTFNXVIDJE-AEJSXWLSSA-N
Molecular Weight 256.689 g/mol
SMILES O[C@]1(CC[C@](N(=O)=O)([C@@](c2cnc(cc2)Cl)(C1)[H])[H])[H]
SPLASH splash10-002f-0920000000-e756ce5d09957470208f
Source of Spectrum F-52-11058-6
Synonyms (1S,3R,4S)-3-(6-chloro-3-pyridinyl)-4-nitrocyclohexanol (1S,3R,4S)-3-(6-chloro-3-pyridinyl)-4-nitro-1-cyclohexanol (1S,3R,4S)-3-(6-chloropyridin-3-yl)-4-nitrocyclohexan-1-ol (1S,3R,4S)-3-(6-chloranylpyridin-3-yl)-4-nitro-cyclohexan-1-ol
Wiley ID 798276