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Ethyl cis-3-(4-nitrophenyl)cyclohexane carboxylate
SpectraBase Compound ID 195Sb1vWmvi
InChI InChI=1S/C15H19NO4/c1-2-20-15(17)13-5-3-4-12(10-13)11-6-8-14(9-7-11)16(18)19/h6-9,12-13H,2-5,10H2,1H3/t12-,13+/m0/s1
InChIKey PVROJFZWNCSDSO-QWHCGFSZSA-N
Mol Weight 277.32 g/mol
Molecular Formula C15H19NO4
Exact Mass 277.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID iFyrMvfqKj
Name Ethyl cis-3-(4-nitrophenyl)cyclohexane carboxylate
Alternate Name(s) (1R,3S)-ethyl 3-(4-nitrophenyl)cyclohexanecarboxylate
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Formula C15H19NO4
InChI InChI=1S/C15H19NO4/c1-2-20-15(17)13-5-3-4-12(10-13)11-6-8-14(9-7-11)16(18)19/h6-9,12-13H,2-5,10H2,1H3/t12-,13+/m0/s1
InChIKey PVROJFZWNCSDSO-QWHCGFSZSA-N
Literature Reference DOI 10.1021/ol403673e
Molecular Weight 277.320 g/mol
SMILES C1C[C@@](C[C@@](C1)(C(OCC)=O)[H])(c1ccc(cc1)[N+](=O)[O-])[H]
SPLASH splash10-0fb9-3790000000-0de92f78cc68d378373d
Source of Spectrum A1-16-924/SM42-3bd
Wiley ID 1747721