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(E)-3-hydroxy-5-phenyl-4-pentenoic acid propan-2-yl ester
SpectraBase Compound ID Hjgiw3DNMSp
InChI InChI=1S/C14H18O3/c1-11(2)17-14(16)10-13(15)9-8-12-6-4-3-5-7-12/h3-9,11,13,15H,10H2,1-2H3/b9-8+
InChIKey IOHCVUHATHMMOQ-CMDGGOBGSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 925piYnWuec
Name (E)-3-hydroxy-5-phenyl-4-pentenoic acid propan-2-yl ester
Alternate Name(s) (E)-3-hydroxy-5-phenyl-pent-4-enoic acid isopropyl ester Propan-2-yl (E)-3-hydroxy-5-phenylpent-4-enoate Propan-2-yl (E)-3-oxidanyl-5-phenyl-pent-4-enoate
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Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-11(2)17-14(16)10-13(15)9-8-12-6-4-3-5-7-12/h3-9,11,13,15H,10H2,1-2H3/b9-8+
InChIKey IOHCVUHATHMMOQ-CMDGGOBGSA-N
Molecular Weight 234.295 g/mol
SMILES OC(CC(=O)OC(C)C)\C=C\c1ccccc1
SPLASH splash10-001i-0910000000-fd4415dd159ef268576d
Source of Spectrum K-2001-1056-8
Wiley ID 1578868