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3-BENZYL-2-ETHOXY-PENT-1-EN-4-ONE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-BENZYL-2-ETHOXY-PENT-1-EN-4-ONE
SpectraBase Compound ID 339PK8BrrLh
InChI InChI=1S/C14H18O2/c1-4-16-12(3)14(11(2)15)10-13-8-6-5-7-9-13/h5-9,14H,3-4,10H2,1-2H3
InChIKey XQMFAHKSCLLWQU-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTAbKBEVKll
Name 3-Benzyl-4-ethoxy-pent-4-en-2-one
Alternate Name(s) 4-Ethoxy-3-(phenylmethyl)-4-penten-2-one 4-Ethoxy-3-(phenylmethyl)pent-4-en-2-one
CAS Registry Number 78890-86-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-4-16-12(3)14(11(2)15)10-13-8-6-5-7-9-13/h5-9,14H,3-4,10H2,1-2H3
InChIKey XQMFAHKSCLLWQU-UHFFFAOYSA-N
Molecular Weight 218.296 g/mol
SMILES C(C(=C)OCC)(C(=O)C)Cc1ccccc1
SPLASH splash10-005c-4900000000-e117878da77a6b9eddce
Source of Spectrum J-46-4651-0
Wiley ID 1217896