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2-Cyclohexen-1-one, 3-methyl-6-[1-(methyl-D3)ethyl-2,2,2-D3]-
SpectraBase Compound ID ISWwfMpUBKl
InChI InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3/i1D3,2D3
InChIKey YSTPAHQEHQSRJD-WFGJKAKNSA-N
Mol Weight 158.27 g/mol
Molecular Formula C10H10D6O
Exact Mass 158.157776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqzMqFVGK2v
Name 2-Cyclohexen-1-one, 3-methyl-6-[1-(methyl-D3)ethyl-2,2,2-D3]-
Alternate Name(s) 3-Methyl-6-(1-methyl-(1,1,1-D3)ethyl-2,2,2-D3)-2-cyclohexen-1-one
CAS Registry Number 54326-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10D6O
InChI InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3/i1D3,2D3
InChIKey YSTPAHQEHQSRJD-WFGJKAKNSA-N
Molecular Weight 158.274 g/mol
SMILES C1(C=C(C)CCC1C(C([D])([D])[D])C([D])([D])[D])=O
SPLASH splash10-000x-9100000000-ea435de9d0eb44f73267
Source of Spectrum T-67-1820-0
Wiley ID 10614