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[4,4-2H2]-4-(Benzyloxy)-2-butanone
SpectraBase Compound ID DiqhtLtZFoy
InChI InChI=1S/C11H14O2/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3/i8D2
InChIKey BTOZGSIVAZGXCH-MGVXTIMCSA-N
Mol Weight 180.24 g/mol
Molecular Formula C11H122D2O2
Exact Mass 180.111933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hcy7m1MIX6
Name [4,4-2H2]-4-(Benzyloxy)-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12D2O2
InChI InChI=1S/C11H14O2/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3/i8D2
InChIKey BTOZGSIVAZGXCH-MGVXTIMCSA-N
Molecular Weight 180.243 g/mol
SMILES C(=O)(CC(OCc1ccccc1)([2D])[2D])C
SPLASH splash10-0006-9200000000-edf27c5f75f84766da6c
Source of Spectrum U1-2011-3344-7c
Synonyms 4,4-Dideuterio-4-phenylmethoxy-2-butanone 4,4-Dideuterio-4-phenylmethoxybutan-2-one 4-Benzyloxy-4,4-dideuterio-butan-2-one 4,4-Dideuterio-4-phenylmethoxy-butan-2-one
Wiley ID 1665692