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Dimethyl (3Z)-3-hexenedioate
SpectraBase Compound ID KIF8pImavx6
InChI InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3/b4-3-
InChIKey CPSQPCGPYWRIPB-ARJAWSKDSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EdpWc4VkgQ
Name Dimethyl (3Z)-3-hexenedioate
Alternate Name(s) (Z)-3-hexenedioic acid dimethyl ester (Z)-hex-3-enedioic acid dimethyl ester 3-Hexenedioic acid, dimethyl ester, (Z)- Dimethyl (Z)-hex-3-enedioate
CAS Registry Number 70354-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3/b4-3-
InChIKey CPSQPCGPYWRIPB-ARJAWSKDSA-N
Molecular Weight 172.180 g/mol
SMILES C(=O)(OC)C\C=C/CC(=O)OC
SPLASH splash10-0abc-9400000000-c88e91989769d59690c7
Source of Spectrum HE-1986-1041-0
Wiley ID 1168408