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(Z)-3-methyl-4-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)but-3-en-2-one
SpectraBase Compound ID Ca351z02Lrl
InChI InChI=1S/C14H22O2/c1-9(11(3)15)8-12-10(2)13(16)6-7-14(12,4)5/h8,13,16H,6-7H2,1-5H3/b9-8-
InChIKey HWLKSMXYWGSQEO-HJWRWDBZSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdlMsgT1UVa
Name (Z)-3-methyl-4-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)but-3-en-2-one
CAS Registry Number 97306-67-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-9(11(3)15)8-12-10(2)13(16)6-7-14(12,4)5/h8,13,16H,6-7H2,1-5H3/b9-8-
InChIKey HWLKSMXYWGSQEO-HJWRWDBZSA-N
Molecular Weight 222.328 g/mol
SMILES OC1C(=C(\C=C/(C(=O)C)C)C(CC1)(C)C)C
SPLASH splash10-0596-8910000000-c3e9455b9aebbd3f88b7
Source of Spectrum H-68-202-0
Synonyms (Z)-4-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3-methyl-3-buten-2-one (Z)-4-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)-3-methyl-but-3-en-2-one
Wiley ID 1222906