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4-Trideuteriomethyl-6,6-dimethyl-2,2,3,5,5-pentadeuteriocyclohex-3-en-1-one
SpectraBase Compound ID 3zcMNmlt0Ht
InChI InChI=1S/C9H14O/c1-7-4-5-8(10)9(2,3)6-7/h4H,5-6H2,1-3H3/i1D3,4D,5D2,6D2
InChIKey DOHOIXIEDXFGEH-WOACEMEVSA-N
Mol Weight 146.26 g/mol
Molecular Formula C9H6D8O
Exact Mass 146.154679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iz5YJYZTUkY
Name 4-Trideuteriomethyl-6,6-dimethyl-2,2,3,5,5-pentadeuteriocyclohex-3-en-1-one
Alternate Name(s) 4-(Trideuteriomethyl)-6,6-dimethyl-2,2,3,5,5-pentadeuteriocyclohex-3-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6D8O
InChI InChI=1S/C9H14O/c1-7-4-5-8(10)9(2,3)6-7/h4H,5-6H2,1-3H3/i1D3,4D,5D2,6D2
InChIKey DOHOIXIEDXFGEH-WOACEMEVSA-N
Molecular Weight 146.259 g/mol
SMILES C1(C(C([D])([D])C(=C(C1([D])[D])C([D])([D])[D])[D])=O)(C)C
SPLASH splash10-000i-9000000000-f808d94b55d4e11a55de
Source of Spectrum NW-955-0-0
Wiley ID 1138277