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2-Piperidinecarboxylic acid, 1-[(4-ethoxy-2-nitrophenyl)sulfonyl]-
SpectraBase Compound ID 78hSuq3W6Nn
InChI InChI=1S/C14H18N2O7S/c1-2-23-10-6-7-13(12(9-10)16(19)20)24(21,22)15-8-4-3-5-11(15)14(17)18/h6-7,9,11H,2-5,8H2,1H3,(H,17,18)
InChIKey CXPAGKZBSZACKK-UHFFFAOYSA-N
Mol Weight 358.37 g/mol
Molecular Formula C14H18N2O7S
Exact Mass 358.083472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KMlkRcy4Ju
Name 2-Piperidinecarboxylic acid, 1-[(4-ethoxy-2-nitrophenyl)sulfonyl]-
Alternate Name(s) 1-[(4-ethoxy-2-nitrophenyl)sulfonyl]-2-piperidinecarboxylic acid N-(4-ethoxy-2-nitrophenylsulphonyl)piperidine-2-carboxylic acid
CAS Registry Number 130178-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2O7S
InChI InChI=1S/C14H18N2O7S/c1-2-23-10-6-7-13(12(9-10)16(19)20)24(21,22)15-8-4-3-5-11(15)14(17)18/h6-7,9,11H,2-5,8H2,1H3,(H,17,18)
InChIKey CXPAGKZBSZACKK-UHFFFAOYSA-N
Molecular Weight 358.365 g/mol
SMILES OC(C1N(S(c2c(N(=O)=O)cc(cc2)OCC)(=O)=O)CCCC1)=O
SPLASH splash10-06si-0069000000-a94f286f952665aafb2d
Source of Spectrum KC-1990-1836-3
Wiley ID 1346781