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1,3-Cyclohexanedione, 2-(ethyl-2,2,2-D3)-5,5-dimethyl-
SpectraBase Compound ID 6iRCJToQefG
InChI InChI=1S/C10H16O2/c1-4-7-8(11)5-10(2,3)6-9(7)12/h7H,4-6H2,1-3H3/i1D3
InChIKey GOSMSPNTUUZKBY-FIBGUPNXSA-N
Mol Weight 171.25 g/mol
Molecular Formula C10H13D3O2
Exact Mass 171.13386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qZmvrbp7MS
Name 1,3-Cyclohexanedione, 2-(ethyl-2,2,2-D3)-5,5-dimethyl-
Alternate Name(s) 2-(Ethyl-2,2,2-D3)-5,5-dimethyl-1,3-cyclohexadione
CAS Registry Number 17206-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13D3O2
InChI InChI=1S/C10H16O2/c1-4-7-8(11)5-10(2,3)6-9(7)12/h7H,4-6H2,1-3H3/i1D3
InChIKey GOSMSPNTUUZKBY-FIBGUPNXSA-N
Molecular Weight 171.254 g/mol
SMILES C1(C(C(=O)CC(C1)(C)C)CC([D])([D])[D])=O
SPLASH splash10-001i-9200000000-12d9edd507b3ac88fbe9
Source of Spectrum T-67-1837-0
Wiley ID 14950