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4-PHENYL-3-ENOIC-ACID-METHYLESTER
SpectraBase Compound ID 4mNKAvxC6b5
InChI InChI=1S/C11H12O2/c1-13-11(12)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3/b8-5+
InChIKey VOEDRUGFNJEWGQ-VMPITWQZSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbANsp3CPZc
Name (E)-4-phenyl-3-butenoic acid methyl ester
CAS Registry Number 24891-74-5
Comments Less than 3 mono-isotopic peaks
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Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-13-11(12)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3/b8-5+
InChIKey VOEDRUGFNJEWGQ-VMPITWQZSA-N
Molecular Weight 176.215 g/mol
SMILES C(=O)(OC)C\C=C\c1ccccc1
SPLASH splash10-014i-0900000000-ad2b15ea744abab3c182
Source of Spectrum SO-0-246-3
Synonyms 3-Butenoic acid, 4-phenyl-, methyl ester (E)-4-phenylbut-3-enoic acid methyl ester Methyl (3E)-4-phenyl-3-butenoate Methyl 4-Phenylbut-3-enoate methyl (E)-4-phenylbut-3-enoate
Wiley ID 872953