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Dimethyl (2Z)-2-[2-(anilinocarbonyl)-3-methyl-2-butenyl]-2-butenedioate
SpectraBase Compound ID A1Gj2gZucOU
InChI InChI=1S/C18H21NO5/c1-12(2)15(17(21)19-14-8-6-5-7-9-14)10-13(18(22)24-4)11-16(20)23-3/h5-9,11H,10H2,1-4H3,(H,19,21)/b13-11-
InChIKey IPFWGVFYXBKKPI-QBFSEMIESA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IIb8jPKBrL
Name Dimethyl (2Z)-2-[2-(anilinocarbonyl)-3-methyl-2-butenyl]-2-butenedioate
Alternate Name(s) (Z)-2-[2-[anilino(oxo)methyl]-3-methylbut-2-enyl]-2-butenedioic acid dimethyl ester (Z)-2-[3-methyl-2-(phenylcarbamoyl)but-2-enyl]but-2-enedioic acid dimethyl ester 2-Butenedioic acid, 2-[3-methyl-2-[(phenylamino)carbonyl]-2-butenyl]-, dimethyl ester, (Z)- Dimethyl (Z)-2-[3-methyl-2-(phenylcarbamoyl)but-2-enyl]but-2-enedioate
CAS Registry Number 95383-62-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-12(2)15(17(21)19-14-8-6-5-7-9-14)10-13(18(22)24-4)11-16(20)23-3/h5-9,11H,10H2,1-4H3,(H,19,21)/b13-11-
InChIKey IPFWGVFYXBKKPI-QBFSEMIESA-N
Molecular Weight 331.368 g/mol
SMILES N(c1ccccc1)C(=O)C(=C(C)C)C\C(=C\C(=O)OC)C(=O)OC
SPLASH splash10-004i-7940000000-bf4a72c93bc71f1b2572
Source of Spectrum HE-1986-1059-0
Wiley ID 1328688