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Cyclohexanone-3-D, 4-(1,1-dimethylethyl)-, (3R-trans)-
SpectraBase Compound ID AcM5Hcgi3UN
InChI InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3/i4D/t4-,8?/m1/s1
InChIKey YKFKEYKJGVSEIX-JNCKDNDPSA-N
Mol Weight 155.26 g/mol
Molecular Formula C10H17DO
Exact Mass 155.142042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dD7ZW8KYhZ
Name Cyclohexanone-3-D, 4-(1,1-dimethylethyl)-, (3R-trans)-
CAS Registry Number 68778-92-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17DO
InChI InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3/i4D/t4-,8?/m1/s1
InChIKey YKFKEYKJGVSEIX-JNCKDNDPSA-N
Molecular Weight 155.259 g/mol
SMILES C(C1[C@@](CC(CC1)=O)([D])[H])(C)(C)C
SPLASH splash10-0a4j-9100000000-d7fc79aeac39d168da62
Source of Spectrum J-45-2684-0
Synonyms (3R)-3-Deuterio-4-tert-butylcyclohexanone (3R-trans)-4-(1,1-Dimethylethyl)-cyclohexanone-3-D
Wiley ID 1152367