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.alpha.-Irone
SpectraBase Compound ID DKoOal1zHhj
InChI InChI=1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+
InChIKey JZQOJFLIJNRDHK-CMDGGOBGSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvI2kcHgwCG
Name (3E)-4-(2,5,6,6-Tetramethyl-2-cyclohexen-1-yl)-3-buten-2-one
Alternate Name(s) (E)-4-(2,5,6,6-tetramethyl-1-cyclohex-2-enyl)-3-buten-2-one Methyl alpha-ionone (E)-4-(2,5,6,6-tetramethylcyclohex-2-en-1-yl)but-3-en-2-one .alpha.-Ionone, 6-methyl- 6-Methyl-alpha-ionone .alpha.-Irone .alpha.-Ionone, methyl- alpha-Ionone, methyl- 3-Buten-2-one, 4-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)- 3-Buten-2-one, 4-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)-, cis- 4-(2,5,6,6-Tetramethyl-2-cyclo-hexen-1-yl)-3-buten-2-one 4-(2,5,6,6-Tetramethylcyclohex-2-enyl)but-3-en-2-one 6-Methyl-.alpha.-ionone cis-.alpha.-Irone Irone .alpha. b Irone, .alpha. A Methyl-.alpha.-ionone AI3-36190 BRN 1343498 EINECS 201-219-6 FEMA NO. 2597
CAS Registry Number 79-69-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+
InChIKey JZQOJFLIJNRDHK-CMDGGOBGSA-N
Molecular Weight 206.329 g/mol
SMILES CC1CC=C(C)C(\C=C\C(C)=O)C1(C)C
SPLASH splash10-006x-9700000000-7f15d9155feb9ea9a478
Source of Spectrum UT-1990-1226-0
Wiley ID 1205153