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2,6-D2-mS-inositol
SpectraBase Compound ID 3b9DB3cnfs7
InChI InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/i7D,8D
InChIKey CDAISMWEOUEBRE-QTQOOCSTSA-N
Mol Weight 182.17 g/mol
Molecular Formula C6H102D2O6
Exact Mass 182.075942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3oaPmsjv62
Name 2,6-D2-mS-inositol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10D2O6
InChI InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/i7D,8D
InChIKey CDAISMWEOUEBRE-QTQOOCSTSA-N
Molecular Weight 182.168 g/mol
SMILES OC1C(C(C(C(C1O)O[2D])O[2D])O)O
SPLASH splash10-00di-9000000000-43fa31cd15891bc74eee
Source of Spectrum T-68-708-0
Wiley ID 17952