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2-Butenoic acid, 3-(acetyloxy)-, ethyl ester
SpectraBase Compound ID BGhVl96zq8S
InChI InChI=1S/C8H12O4/c1-4-11-8(10)5-6(2)12-7(3)9/h5H,4H2,1-3H3/b6-5-
InChIKey VSCUAMOPAHJJTA-WAYWQWQTSA-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 GubFPqNrFPt
Name 2-Butenoic acid, 3-(acetyloxy)-, ethyl ester
Alternate Name(s) (Z)-3-acetyloxy-2-butenoic acid ethyl ester Ethyl (Z)-3-acetoxybut-2-enoate Ethyl (Z)-3-acetyloxybut-2-enoate
CAS Registry Number 29214-62-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-4-11-8(10)5-6(2)12-7(3)9/h5H,4H2,1-3H3/b6-5-
InChIKey VSCUAMOPAHJJTA-WAYWQWQTSA-N
Molecular Weight 172.180 g/mol
SMILES C(=O)(OCC)\C=C\(OC(=O)C)C
SPLASH splash10-0016-9200000000-5b3541287b3ab246f708
Source of Spectrum NP-2-5592-0
Wiley ID 1101247