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4-Hexenoic acid, 5-(2-methoxyphenyl)-3-oxo-, methyl ester, (E)-
SpectraBase Compound ID HieeXo6MZtY
InChI InChI=1S/C14H16O4/c1-10(8-11(15)9-14(16)18-3)12-6-4-5-7-13(12)17-2/h4-8H,9H2,1-3H3/b10-8+
InChIKey SNHDXMKAFBXNFL-CSKARUKUSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GktCQsB38Xw
Name 4-Hexenoic acid, 5-(2-methoxyphenyl)-3-oxo-, methyl ester, (E)-
CAS Registry Number 35468-88-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-10(8-11(15)9-14(16)18-3)12-6-4-5-7-13(12)17-2/h4-8H,9H2,1-3H3/b10-8+
InChIKey SNHDXMKAFBXNFL-CSKARUKUSA-N
Molecular Weight 248.278 g/mol
SMILES C(\C=C\(c1c(OC)cccc1)C)(CC(=O)OC)=O
SPLASH splash10-0a4i-2910000000-3f899662f0a3f679f7fa
Source of Spectrum I-52-2161-5
Synonyms Methyl (4E)-5-(2-methoxyphenyl)-3-oxo-4-hexenoate Methyl 5-(2-methoxyphenyl)-3-oxohex-4-enoate
Wiley ID 1251028