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Cgw5swOpAOc
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Cgw5swOpAOc
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3,5,5-trimethyl-4-[(1E,3E)-3-methyl-5-oxidanyl-penta-1,3-dienyl]cyclohex-2-en-1-one
SpectraBase Compound ID JXLU9XBgEnQ
InChI InChI=1S/C15H22O2/c1-11(7-8-16)5-6-14-12(2)9-13(17)10-15(14,3)4/h5-7,9,14,16H,8,10H2,1-4H3/b6-5+,11-7+
InChIKey ZRSDLQWKEAXXBP-LCAICKDSSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cgw5swOpAOc
Name 3,5,5-trimethyl-4-[(1E,3E)-3-methyl-5-oxidanyl-penta-1,3-dienyl]cyclohex-2-en-1-one
CAS Registry Number 83020-77-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-11(7-8-16)5-6-14-12(2)9-13(17)10-15(14,3)4/h5-7,9,14,16H,8,10H2,1-4H3/b6-5+,11-7+
InChIKey ZRSDLQWKEAXXBP-LCAICKDSSA-N
Molecular Weight 234.339 g/mol
SMILES OC\C=C\(\C=C\C1C(=CC(CC1(C)C)=O)C)C
SPLASH splash10-052e-3900000000-4c6f7dd3abd809b0bf8b
Source of Spectrum H-65-964-0
Synonyms 4-[(1E,3E)-5-hydroxy-3-methyl-penta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one 4-[(1E,3E)-5-hydroxy-3-methylpenta-1,3-dienyl]-3,5,5-trimethyl-1-cyclohex-2-enone
Wiley ID 1236297
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