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(2S)-N-(4-[2,3-Epoxypropoxy]-5-methoxy-2-nitrobenzoyl)-pyrrolidine-2-carboxaldehyde Dimethyl acetal
SpectraBase Compound ID IvJVxe5IXmB
InChI InChI=1S/C18H24N2O8/c1-24-15-7-12(14(20(22)23)8-16(15)28-10-11-9-27-11)17(21)19-6-4-5-13(19)18(25-2)26-3/h7-8,11,13,18H,4-6,9-10H2,1-3H3/t11?,13-/m0/s1
InChIKey UMECPDYTJILQHU-YUZLPWPTSA-N
Mol Weight 396.4 g/mol
Molecular Formula C18H24N2O8
Exact Mass 396.153266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GPSycWPFi1
Name (2S)-N-(4-[2,3-Epoxypropoxy]-5-methoxy-2-nitrobenzoyl)-pyrrolidine-2-carboxaldehyde Dimethyl acetal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O8
InChI InChI=1S/C18H24N2O8/c1-24-15-7-12(14(20(22)23)8-16(15)28-10-11-9-27-11)17(21)19-6-4-5-13(19)18(25-2)26-3/h7-8,11,13,18H,4-6,9-10H2,1-3H3/t11?,13-/m0/s1
InChIKey UMECPDYTJILQHU-YUZLPWPTSA-N
Molecular Weight 396.396 g/mol
SMILES [C@]1(N(CCC1)C(c1c(cc(c(c1)OC)OCC1CO1)N(=O)=O)=O)(C(OC)OC)[H]
SPLASH splash10-004i-9161000000-c878c6ba7284969a8c50
Source of Spectrum F2-42-4038-21
Synonyms (2S)-2-(dimethoxymethyl)-1-[5-methoxy-2-nitro-4-(2-oxiranylmethoxy)benzoyl]pyrrolidine [(2S)-2-(dimethoxymethyl)-1-pyrrolidinyl]-[5-methoxy-2-nitro-4-(2-oxiranylmethoxy)phenyl]methanone [(2S)-2-(dimethoxymethyl)pyrrolidin-1-yl]-[5-methoxy-2-nitro-4-(oxiran-2-ylmethoxy)phenyl]methanone [(2S)-2-(dimethoxymethyl)pyrrolidino]-(4-glycidoxy-5-methoxy-2-nitro-phenyl)methanone
Wiley ID 1600436