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3-Phenylpropyl 2,4-dimethyl-2-pentenoate
SpectraBase Compound ID AQAJm5wbFKI
InChI InChI=1S/C16H22O2/c1-13(2)12-14(3)16(17)18-11-7-10-15-8-5-4-6-9-15/h4-6,8-9,12-13H,7,10-11H2,1-3H3/b14-12+
InChIKey HZVJGDHBZIZMDJ-WYMLVPIESA-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 36JGTDMb3xa
Name 3-Phenylpropyl 2,4-dimethyl-2-pentenoate
CAS Registry Number 125427-84-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-13(2)12-14(3)16(17)18-11-7-10-15-8-5-4-6-9-15/h4-6,8-9,12-13H,7,10-11H2,1-3H3/b14-12+
InChIKey HZVJGDHBZIZMDJ-WYMLVPIESA-N
Molecular Weight 246.350 g/mol
SMILES C(\C(=C\C(C)C)C)(=O)OCCCc1ccccc1
SPLASH splash10-07w9-9800000000-606dc335195ff7431189
Source of Spectrum F-45-6185-7
Synonyms 3-Phenylpropyl (2E)-2,4-dimethyl-2-pentenoate
Wiley ID 1249396