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Cyclohexane-1,1,2,2,3-d5, 3-methyl-6-(1-methylethenyl)-, (3S-trans)-
SpectraBase Compound ID HyasYGuWcgt
InChI InChI=1S/C10H18/c1-8(2)10-6-4-9(3)5-7-10/h9-10H,1,4-7H2,2-3H3/t9-,10+/i4D2,6D2,9D/m1/s1
InChIKey WPMKLOWQWIDOJN-NNYFRFNCSA-N
Mol Weight 143.28 g/mol
Molecular Formula C10H13D5
Exact Mass 143.172234 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KfuYsXNJq55
Name Cyclohexane-1,1,2,2,3-d5, 3-methyl-6-(1-methylethenyl)-, (3S-trans)-
CAS Registry Number 73687-70-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13D5
InChI InChI=1S/C10H18/c1-8(2)10-6-4-9(3)5-7-10/h9-10H,1,4-7H2,2-3H3/t9-,10+/i4D2,6D2,9D/m1/s1
InChIKey WPMKLOWQWIDOJN-NNYFRFNCSA-N
Molecular Weight 143.285 g/mol
SMILES C([C@@]1(CC[C@@](C(C1([D])[D])([D])[D])(C)[D])[H])(=C)C
SPLASH splash10-00dl-9500000000-ea26dd7f19fb9e8bf09c
Source of Spectrum J-45-2683-0
Synonyms (1S,4S)-1-isopropenyl-2.2.3.3.4-pentadeuterio-4-methylcyclohexanone
Wiley ID 1138411