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3-Methyl-2-phenyl-2-butenoic acid ethyl ester
SpectraBase Compound ID BWoaQphTQtb
InChI InChI=1S/C13H16O2/c1-4-15-13(14)12(10(2)3)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKey XCOMMVMHCUNDKB-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 937v1F7z0MJ
Name 3-Methyl-2-phenyl-2-butenoic acid ethyl ester
Alternate Name(s) 3-Methyl-2-phenyl-but-2-enoic acid ethyl ester Ethyl 3-methyl-2-phenyl-but-2-enoate
CAS Registry Number 6335-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-4-15-13(14)12(10(2)3)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3
InChIKey XCOMMVMHCUNDKB-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES CC(=C(C(=O)OCC)c1ccccc1)C
SPLASH splash10-0kai-0940000000-92800ff3b73e98afbf45
Source of Spectrum J-53-609-6
Wiley ID 1202073