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Diethyl 2-butenedioate
SpectraBase Compound ID HMm0FSO0SOL
InChI InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3
InChIKey IEPRKVQEAMIZSS-UHFFFAOYSA-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 s0RNXwNIkL
Name Diethyl 2-butenedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 172.073558862 u
Formula C8H12O4
GC Column DB-5 (30 m x 0.25 mm)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3
InChIKey IEPRKVQEAMIZSS-UHFFFAOYSA-N
Instrument Name Shimadzu QP-2010
Ionization Type EI
Literature Reference DOI 10.1002/chem.202201474
Molecular Weight 172.180 g/mol
Quality 323
SMILES C(C)OC(C=CC(=O)OCC)=O
SPLASH splash10-0002-9200000000-244ae991784cef70396a
Source of Spectrum QE-28-SM14-14-2 (DOI: 10.1002/chem.202201474)
Wiley ID 1902446