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1-Benzyl 4-propyl (2Z)-2-butenedioate
SpectraBase Compound ID ADuzHJDOyAt
InChI InChI=1S/C14H16O4/c1-2-10-17-13(15)8-9-14(16)18-11-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3/b9-8-
InChIKey TUUDYDFBLHAVBV-HJWRWDBZSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EV8Tu8zRYtX
Name 1-Benzyl 4-propyl (2Z)-2-butenedioate
Alternate Name(s) (Z)-2-butenedioic acid O4-(phenylmethyl) ester O1-propyl ester (Z)-but-2-enedioic acid O4-benzyl ester O1-propyl ester 4-O-benzyl 1-O-propyl (Z)-but-2-enedioate Benzyl propyl maleate O4-(phenylmethyl) O1-propyl (Z)-but-2-enedioate O4-benzyl O1-propyl (Z)-but-2-enedioate
CAS Registry Number 105113-85-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-2-10-17-13(15)8-9-14(16)18-11-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3/b9-8-
InChIKey TUUDYDFBLHAVBV-HJWRWDBZSA-N
Molecular Weight 248.278 g/mol
SMILES CCCOC(=O)\C=C/C(=O)OCc1ccccc1
SPLASH splash10-0f6x-9500000000-a3f6875dbf9360285a76
Source of Spectrum JC-367-204-0
Wiley ID 1251083