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3,5,5-trimethyl-4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-cyclohex-2-enone
SpectraBase Compound ID 4qQCwmv6gri
InChI InChI=1S/C18H20O2/c1-13-11-15(19)12-18(2,3)17(13)16(20)10-9-14-7-5-4-6-8-14/h4-11,17H,12H2,1-3H3/b10-9+
InChIKey SRNKHHGUGBDMBN-MDZDMXLPSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FCBD7wJX8U
Name 3,5,5-trimethyl-4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-cyclohex-2-enone
Alternate Name(s) 3,5,5-trimethyl-4-[(E)-3-phenylacryloyl]cyclohex-2-en-1-one 3,5,5-trimethyl-4-[(E)-3-phenylprop-2-enoyl]cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-13-11-15(19)12-18(2,3)17(13)16(20)10-9-14-7-5-4-6-8-14/h4-11,17H,12H2,1-3H3/b10-9+
InChIKey SRNKHHGUGBDMBN-MDZDMXLPSA-N
Molecular Weight 268.356 g/mol
SMILES C=1(C(C(C)(C)CC(C1)=O)C(\C=C\c1ccccc1)=O)C
SPLASH splash10-001i-2900000000-fb3ca7eb0de7a5ae73c3
Source of Spectrum J-63-9444-4
Wiley ID 1272694