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(-)-CIS-ALPHA-IRONE
SpectraBase Compound ID IdHS7YVPM5p
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+/t11-,13+/m0/s1
InChIKey JZQOJFLIJNRDHK-MDQMCFMNSA-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 FcADY3Lj7Nt
Name (E)-4-[(1R,5S)-2,5,6,6-tetramethyl-1-cyclohex-2-enyl]-3-buten-2-one
Alternate Name(s) (E)-4-[(1R,5S)-2,5,6,6-tetramethylcyclohex-2-en-1-yl]but-3-en-2-one
CAS Registry Number 72074-85-2
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+/t11-,13+/m0/s1
InChIKey JZQOJFLIJNRDHK-MDQMCFMNSA-N
Molecular Weight 206.329 g/mol
SMILES [C@]1(C([C@@](C)(CC=C1C)[H])(C)C)(\C=C\C(=O)C)[H]
SPLASH splash10-006x-6900000000-75c04ef4dc267c7f6984
Source of Spectrum H-76-2082-0
Wiley ID 1205264