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(2s)-n-(2-nitrobenzoyl)pyrrolidinemethanol
SpectraBase Compound ID 7IGtHxTURkl
InChI InChI=1S/C12H14N2O4/c15-8-9-4-3-7-13(9)12(16)10-5-1-2-6-11(10)14(17)18/h1-2,5-6,9,15H,3-4,7-8H2/t9-/m0/s1
InChIKey WSNWTEDNJVCMEI-VIFPVBQESA-N
Mol Weight 250.25 g/mol
Molecular Formula C12H14N2O4
Exact Mass 250.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nLExe7K0bF
Name (2s)-n-(2-nitrobenzoyl)pyrrolidinemethanol
Alternate Name(s) [(2S)-1-(2-nitrobenzoyl)pyrrolidinyl]methanol [(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-(2-nitrophenyl)methanone [(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(2-nitrophenyl)methanone
CAS Registry Number 72435-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O4
InChI InChI=1S/C12H14N2O4/c15-8-9-4-3-7-13(9)12(16)10-5-1-2-6-11(10)14(17)18/h1-2,5-6,9,15H,3-4,7-8H2/t9-/m0/s1
InChIKey WSNWTEDNJVCMEI-VIFPVBQESA-N
Molecular Weight 250.254 g/mol
SMILES OC[C@]1(N(C(c2c(N(=O)=O)cccc2)=O)CCC1)[H]
SPLASH splash10-0uxr-1980000000-09a48667213ce0562e3e
Source of Spectrum J-51-709-14
Wiley ID 1252974