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2-Butenedioic acid, 2-(dimethylamino)-3-(2-propenyl)-, dimethyl ester, (E)-
SpectraBase Compound ID GXnu6EndV6a
InChI InChI=1S/C11H17NO4/c1-6-7-8(10(13)15-4)9(12(2)3)11(14)16-5/h6H,1,7H2,2-5H3/b9-8+
InChIKey KGNLXNMEELQVAW-CMDGGOBGSA-N
Mol Weight 227.26 g/mol
Molecular Formula C11H17NO4
Exact Mass 227.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbIUpTw8r2l
Name 2-Butenedioic acid, 2-(dimethylamino)-3-(2-propenyl)-, dimethyl ester, (E)-
Alternate Name(s) 1-(dimethylamino)-2,3-acetoxy-1,4-pentadiene Dimethyl (2E)-2-allyl-3-(dimethylamino)-2-butenedioate
CAS Registry Number 118509-84-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO4
InChI InChI=1S/C11H17NO4/c1-6-7-8(10(13)15-4)9(12(2)3)11(14)16-5/h6H,1,7H2,2-5H3/b9-8+
InChIKey KGNLXNMEELQVAW-CMDGGOBGSA-N
Molecular Weight 227.260 g/mol
SMILES C(\C(=C/(C(=O)OC)CC=C)N(C)C)(=O)OC
SPLASH splash10-066r-0910000000-4c646eae75828be2977d
Source of Spectrum I-66-1693-2
Wiley ID 1228505