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2-Oxocanone-3,3,8,8-D4
SpectraBase Compound ID B2aOGHAKXBW
InChI InChI=1S/C7H12O2/c8-7-5-3-1-2-4-6-9-7/h1-6H2/i5D2,6D2
InChIKey BTLSLHNLDQCWKS-NZLXMSDQSA-N
Mol Weight 132.2 g/mol
Molecular Formula C7H82H4O2
Exact Mass 132.108837 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsIctBHJQu4
Name 2-Oxocanone-3,3,8,8-D4
CAS Registry Number 137435-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8D4O2
InChI InChI=1S/C7H12O2/c8-7-5-3-1-2-4-6-9-7/h1-6H2/i5D2,6D2
InChIKey BTLSLHNLDQCWKS-NZLXMSDQSA-N
Molecular Weight 132.195 g/mol
SMILES C1(OC(CCCCC1([D])[D])([D])[D])=O
SPLASH splash10-05fr-9200000000-582a1cfdf2e43b805f84
Source of Spectrum J-57-297-2
Wiley ID 1131433