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3-Butenoic acid, 2-(1-methylethylidene)-4-phenyl-, ethyl ester, (E)-
SpectraBase Compound ID HGsmiJ5ZyHR
InChI InChI=1S/C15H18O2/c1-4-17-15(16)14(12(2)3)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b11-10+
InChIKey XNRGMFDUSPHWNX-ZHACJKMWSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIKJ0B4CH3R
Name 3-Butenoic acid, 2-(1-methylethylidene)-4-phenyl-, ethyl ester, (E)-
Alternate Name(s) 1,1-Dimethyl-2-(2'-phenylethenyl)-2-ethoxycarbonyl-ethene Ethyl 3-methyl-2-[(E)-2-phenylethenyl]-2-butenoate
CAS Registry Number 112151-74-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-4-17-15(16)14(12(2)3)11-10-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b11-10+
InChIKey XNRGMFDUSPHWNX-ZHACJKMWSA-N
Molecular Weight 230.307 g/mol
SMILES C(\C=C\c1ccccc1)(C(=O)OCC)=C(C)C
SPLASH splash10-053r-0950000000-e8a364aeeaaafb07f9db
Source of Spectrum J-53-609-6
Wiley ID 1232199