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(+/-)-(E)-1-(CIS-2,5,6,6-TETRAMETHYLCYCLOHEX-2-EN-1-YL)-PENT-1-EN-3-ONE;(10-METHYL-CIS-ALPHA-IRONE)
SpectraBase Compound ID uWOX1DRDVJ
InChI InChI=1S/C15H24O/c1-6-13(16)9-10-14-11(2)7-8-12(3)15(14,4)5/h7,9-10,12,14H,6,8H2,1-5H3/b10-9+/t12-,14+/m1/s1
InChIKey JJCHHEFOILUZAW-MEBOZDAKSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LL6EjSgpfS0
Name (+-)-(E)-1-[cis-2,5,6,6-tetramethylcyclohex-2-en-1-yl]pent-1-en-3-one
Alternate Name(s) (1E)-1-[(1S,5R)-2,5,6,6-tetramethyl-2-cyclohexen-1-yl]-1-penten-3-one (E)-1-[(1S,5R)-2,5,6,6-tetramethyl-1-cyclohex-2-enyl]-1-penten-3-one
CAS Registry Number 124886-53-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-6-13(16)9-10-14-11(2)7-8-12(3)15(14,4)5/h7,9-10,12,14H,6,8H2,1-5H3/b10-9+/t12-,14+/m1/s1
InChIKey JJCHHEFOILUZAW-MEBOZDAKSA-N
Molecular Weight 220.356 g/mol
SMILES [C@@]1(C([C@](C)(CC=C1C)[H])(C)C)(\C=C\C(=O)CC)[H]
SPLASH splash10-0fkc-8910000000-1dbee264309722b40fc9
Source of Spectrum H-72-1414-14
Wiley ID 1220771