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Butyl (E)-2-methyl-5-phenyl-4-pentenoate
SpectraBase Compound ID Hgl1jSfEYWV
InChI InChI=1S/C16H22O2/c1-3-4-13-18-16(17)14(2)9-8-12-15-10-6-5-7-11-15/h5-8,10-12,14H,3-4,9,13H2,1-2H3/b12-8+
InChIKey XEJIKIWVDBGZAR-XYOKQWHBSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaYNaBbpJiu
Name Butyl (E)-2-methyl-5-phenyl-4-pentenoate
Alternate Name(s) (E)-2-methyl-5-phenyl-4-pentenoic acid butyl ester Butyl (E)-2-methyl-5-phenylpent-4-enoate Butyl (E)-2-methyl-5-phenyl-pent-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-3-4-13-18-16(17)14(2)9-8-12-15-10-6-5-7-11-15/h5-8,10-12,14H,3-4,9,13H2,1-2H3/b12-8+
InChIKey XEJIKIWVDBGZAR-XYOKQWHBSA-N
Molecular Weight 246.350 g/mol
SMILES C(=O)(C(C\C=C\c1ccccc1)C)OCCCC
SPLASH splash10-0006-5900000000-6c213b6e050fe6d04665
Source of Spectrum U1-2009-5793-(E)-9e
Wiley ID 1697342