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Ethanone, 1-[3-(hydroxymethyl-D2)-2,2-dimethylcyclobutyl]-, (1R-cis)-
SpectraBase Compound ID 1FYiDA5Ohkl
InChI InChI=1S/C9H16O2/c1-6(11)8-4-7(5-10)9(8,2)3/h7-8,10H,4-5H2,1-3H3/t7-,8+/m1/s1/i5D2
InChIKey RRFQMYCDTHUGSU-RQZHUGGGSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H14D2O2
Exact Mass 158.127583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ir4KCxSUL6A
Name Ethanone, 1-[3-(hydroxymethyl-D2)-2,2-dimethylcyclobutyl]-, (1R-cis)-
Alternate Name(s) (2,2-Dimethyl-3-acetycyclobutyl)(.alpha.,.alpha.-D2)methanol
CAS Registry Number 84803-03-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14D2O2
InChI InChI=1S/C9H16O2/c1-6(11)8-4-7(5-10)9(8,2)3/h7-8,10H,4-5H2,1-3H3/t7-,8+/m1/s1/i5D2
InChIKey RRFQMYCDTHUGSU-RQZHUGGGSA-N
Molecular Weight 158.237 g/mol
SMILES OC([C@]1(C[C@](C1(C)C)(C(=O)C)[H])[H])([D])[D]
SPLASH splash10-00di-9000000000-ee0bef080f27c57dae8d
Source of Spectrum C-105-2412-0
Wiley ID 1153929