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2-Butenedioic acid, 2-(diethylamino)-3-propyl-, dimethyl ester, (E)-
SpectraBase Compound ID 2yJYNbhVNSr
InChI InChI=1S/C13H23NO4/c1-6-9-10(12(15)17-4)11(13(16)18-5)14(7-2)8-3/h6-9H2,1-5H3/b11-10+
InChIKey QSOZLYXRJWEHRZ-ZHACJKMWSA-N
Mol Weight 257.33 g/mol
Molecular Formula C13H23NO4
Exact Mass 257.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2HSArcbOpk
Name 2-Butenedioic acid, 2-(diethylamino)-3-propyl-, dimethyl ester, (E)-
Alternate Name(s) 1,2-Dimethoxycarbonyl-1-diethylamino-1-pentene Dimethyl (2E)-2-(diethylamino)-3-propyl-2-butenedioate
CAS Registry Number 113231-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23NO4
InChI InChI=1S/C13H23NO4/c1-6-9-10(12(15)17-4)11(13(16)18-5)14(7-2)8-3/h6-9H2,1-5H3/b11-10+
InChIKey QSOZLYXRJWEHRZ-ZHACJKMWSA-N
Molecular Weight 257.330 g/mol
SMILES C(\C(=C/(C(=O)OC)CCC)N(CC)CC)(=O)OC
SPLASH splash10-06tb-2970000000-b63160059102b4358ecc
Source of Spectrum KC-1987-2026-8
Wiley ID 1260718