John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FO874JraP3k SpectraBase Spectrum ID=8f2kVuyWVAu

(accessed ).
trans-4-(1,1-Dimethylethyl)-2-(hydroxymethyl)cyclohexanone
SpectraBase Compound ID FO874JraP3k
InChI InChI=1S/C11H20O2/c1-11(2,3)9-4-5-10(13)8(6-9)7-12/h8-9,12H,4-7H2,1-3H3/t8-,9-/m0/s1
InChIKey SZZDTDNPGYRNHA-IUCAKERBSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID 8f2kVuyWVAu
Name trans-4-(1,1-Dimethylethyl)-2-(hydroxymethyl)cyclohexanone
Alternate Name(s) (2S,4S)-4-tert-butyl-2-(hydroxymethyl)cyclohexanone
CAS Registry Number 94537-79-8
Classification Monocyclic monoterpenoids
Comments Less than 3 mono-isotopic peaks
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Formula C11H20O2
InChI InChI=1S/C11H20O2/c1-11(2,3)9-4-5-10(13)8(6-9)7-12/h8-9,12H,4-7H2,1-3H3/t8-,9-/m0/s1
InChIKey SZZDTDNPGYRNHA-IUCAKERBSA-N
SPLASH splash10-0a4i-9000000000-85472a441ad7be256891
Source of Spectrum C-107-2082-0
SpectraBase Batch ID 5r8sXNu5qae
Wiley ID 1180938