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O-D5-1,2,4,3,5-cyclohexanepentol
SpectraBase Compound ID 8iwUYmUtuFp
InChI InChI=1S/C6H12O5/c7-2-1-3(8)5(10)6(11)4(2)9/h2-11H,1H2/i7D,8D,9D,10D,11D
InChIKey IMPKVMRTXBRHRB-RAGZBHKVSA-N
Mol Weight 169.19 g/mol
Molecular Formula C6H7D5O5
Exact Mass 169.099857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4eG4l6kcgB
Name O-D5-1,2,4,3,5-cyclohexanepentol
Alternate Name(s) O-Pentadeutero-1,2,3,4,5-cyclohexanepentol
CAS Registry Number 54547-93-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7D5O5
InChI InChI=1S/C6H12O5/c7-2-1-3(8)5(10)6(11)4(2)9/h2-11H,1H2/i7D,8D,9D,10D,11D
InChIKey IMPKVMRTXBRHRB-RAGZBHKVSA-N
Molecular Weight 169.188 g/mol
SMILES C1(C(C(O[D])CC(C1O[D])O[D])O[D])O[D]
SPLASH splash10-004i-9100000000-b457e6bd76dd44e4a7d5
Source of Spectrum T-68-703-0
Wiley ID 13630