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6-Chloranyl-3,5,5-trimethyl-cyclohex-2-en-1-one
SpectraBase Compound ID E2oO641Wi9j
InChI InChI=1S/C9H13ClO/c1-6-4-7(11)8(10)9(2,3)5-6/h4,8H,5H2,1-3H3
InChIKey LZSCSLQORLJIIM-UHFFFAOYSA-N
Mol Weight 172.65 g/mol
Molecular Formula C9H13ClO
Exact Mass 172.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9PeM1nFzDi2
Name 6-Chloranyl-3,5,5-trimethyl-cyclohex-2-en-1-one
Alternate Name(s) 6-Chloro-3,5,5-trimethyl-1-cyclohex-2-enone 6-Chloro-3,5,5-trimethyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13ClO
InChI InChI=1S/C9H13ClO/c1-6-4-7(11)8(10)9(2,3)5-6/h4,8H,5H2,1-3H3
InChIKey LZSCSLQORLJIIM-UHFFFAOYSA-N
Molecular Weight 172.655 g/mol
SMILES C1(C=C(C)CC(C1Cl)(C)C)=O
SPLASH splash10-001i-9300000000-35c1b0161921615e29d4
Source of Spectrum AJ-64-3751-11
Wiley ID 1168634