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(3R*,5R*)-4,4-Dideuterio-2,6-Dimethyl-3,5-heptanediol
SpectraBase Compound ID GTTt7XhT2YE
InChI InChI=1S/C9H20O2/c1-6(2)8(10)5-9(11)7(3)4/h6-11H,5H2,1-4H3/t8-,9-/m1/s1/i5D2
InChIKey CPHZAYIWNZNICS-BUCNIWEXSA-N
Mol Weight 162.27 g/mol
Molecular Formula C9H18D2O2
Exact Mass 162.158883 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmAsFc22qZJ
Name (3R*,5R*)-4,4-Dideuterio-2,6-Dimethyl-3,5-heptanediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18D2O2
InChI InChI=1S/C9H20O2/c1-6(2)8(10)5-9(11)7(3)4/h6-11H,5H2,1-4H3/t8-,9-/m1/s1/i5D2
InChIKey CPHZAYIWNZNICS-BUCNIWEXSA-N
Molecular Weight 162.269 g/mol
SMILES O[C@](C([C@](C(C)C)(O)[H])([D])[D])(C(C)C)[H]
SPLASH splash10-006x-9000000000-94ee860e8cbae2eeec9a
Source of Spectrum F-52-1803-3
Wiley ID 795211