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3,3-Dimethyl-7-hydroxy-2-octanone

View entire compound with spectra: 2 NMR, and 1 MS (GC)

3,3-Dimethyl-7-hydroxy-2-octanone
SpectraBase Compound ID KdWo0Et48zJ
InChI InChI=1S/C10H20O2/c1-8(11)6-5-7-10(3,4)9(2)12/h8,11H,5-7H2,1-4H3
InChIKey UQYNWXHOCGJXHH-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQHpZZsZvAV
Name 7-Hydroxy-3,3-dimethyl-2-octanone
Alternate Name(s) 7-Hydroxy-3,3-dimethyloctan-2-one 3,3-Dimethyl-7-oxidanyl-octan-2-one
CAS Registry Number 65716-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-8(11)6-5-7-10(3,4)9(2)12/h8,11H,5-7H2,1-4H3
InChIKey UQYNWXHOCGJXHH-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES OC(CCCC(C(=O)C)(C)C)C
SPLASH splash10-014i-9100000000-82cc2d6d332ee45e69f9
Source of Spectrum SB-31-795-0
Wiley ID 1169091