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1,3-Cyclohexanedione, 2-butyl-
SpectraBase Compound ID H4212Rxr38x
InChI InChI=1S/C10H16O2/c1-2-3-5-8-9(11)6-4-7-10(8)12/h8H,2-7H2,1H3
InChIKey YMQRPZZAFLGYQY-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23XknnhAlql
Name 1,3-Cyclohexanedione, 2-butyl-
Alternate Name(s) 2-Butyl-1,3-cyclohexanedione 2-Butylcyclohexane-1,3-dione 2-Butylcyclohexane-1,3-quinone
CAS Registry Number 18456-90-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-2-3-5-8-9(11)6-4-7-10(8)12/h8H,2-7H2,1H3
InChIKey YMQRPZZAFLGYQY-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
SMILES C(CC1C(=O)CCCC1=O)CC
SPLASH splash10-08iv-9500000000-767de33ee838c89311b3
Source of Spectrum T-67-1828-0
Wiley ID 14951