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Ethyl 1-(4-chloro-2-nitro-phenyl)piperidine-4-carboxylate
SpectraBase Compound ID 73h74E6IbHP
InChI InChI=1S/C14H17ClN2O4/c1-2-21-14(18)10-5-7-16(8-6-10)12-4-3-11(15)9-13(12)17(19)20/h3-4,9-10H,2,5-8H2,1H3
InChIKey SUQZSCSHIWSCHT-UHFFFAOYSA-N
Mol Weight 312.75 g/mol
Molecular Formula C14H17ClN2O4
Exact Mass 312.087685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aUGEiQhwsA
Name Ethyl 1-(4-chloro-2-nitro-phenyl)piperidine-4-carboxylate
Appearance Dark orange crystals
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Formula C14H17ClN2O4
InChI InChI=1S/C14H17ClN2O4/c1-2-21-14(18)10-5-7-16(8-6-10)12-4-3-11(15)9-13(12)17(19)20/h3-4,9-10H,2,5-8H2,1H3
InChIKey SUQZSCSHIWSCHT-UHFFFAOYSA-N
Instrument Name Varian GCMS Saturn 2100 T
Ionization Type EI
Literature Reference DOI 10.1002/anie.201812068
Molecular Weight 312.753 g/mol
Reported Formula C14H17ClN2O4
SMILES c1c(c(ccc1Cl)N1CCC(CC1)C(=O)OCC)[N+]([O-])=O
SPLASH splash10-006t-0290000000-2db90c520e840ca954ee
Source of Spectrum ACI-58-SM17-3de
Wiley ID 1840443