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[5,5-dideuterate]-3-hydroxydodecan-7-one
SpectraBase Compound ID 5aTqng4gzSo
InChI InChI=1S/C12H24O2/c1-3-5-6-8-12(14)10-7-9-11(13)4-2/h11,13H,3-10H2,1-2H3/i7D2
InChIKey OAFKURCIOFKMMY-RJSZUWSASA-N
Mol Weight 202.33 g/mol
Molecular Formula C12H22D2O2
Exact Mass 202.190184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOaXxnF2a2T
Name [5,5-dideuterate]-3-hydroxydodecan-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22D2O2
InChI InChI=1S/C12H24O2/c1-3-5-6-8-12(14)10-7-9-11(13)4-2/h11,13H,3-10H2,1-2H3/i7D2
InChIKey OAFKURCIOFKMMY-RJSZUWSASA-N
Literature Reference DOI 10.1002/cbic.201000481
Molecular Weight 202.334 g/mol
SMILES OC(CC)CC(CC(CCCCC)=O)([D])[D]
SPLASH splash10-052f-9000000000-25b8f7e11a9331d99b99
Source of Spectrum CBC-12-171-[D2]_9
Synonyms 10-hydroxydodecan-6-one-8,8-d2
Wiley ID 1786698