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(S)-2-Nitro-2-[(S)-2-nitro-1-phenylethyl]cyclohexanone
SpectraBase Compound ID Bz3P0rayG46
InChI InChI=1S/C14H16N2O5/c17-13-8-4-5-9-14(13,16(20)21)12(10-15(18)19)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2/t12-,14+/m1/s1
InChIKey QSFKDZCKINAHIZ-OCCSQVGLSA-N
Mol Weight 292.29 g/mol
Molecular Formula C14H16N2O5
Exact Mass 292.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJFIHYH78d5
Name (S)-2-Nitro-2-[(S)-2-nitro-1-phenylethyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O5
InChI InChI=1S/C14H16N2O5/c17-13-8-4-5-9-14(13,16(20)21)12(10-15(18)19)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2/t12-,14+/m1/s1
InChIKey QSFKDZCKINAHIZ-OCCSQVGLSA-N
Literature Reference DOI 10.1021/ol302005f
Molecular Weight 292.291 g/mol
SMILES c1cccc(c1)[C@]([C@@]1(C(CCCC1)=O)[N+](=O)[O-])(C[N+](=O)[O-])[H]
SPLASH splash10-0fbd-5900000000-97d2f6c6fe1d5ac8ae4d
Source of Spectrum A1-14-4518/SMS14-7b
Synonyms (S)-2-nitro-2-((S)-2-nitro-1-phenylethyl)cyclohexanone
Wiley ID 1750582