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3-deutero-3-phenylpropane-1-ol
SpectraBase Compound ID IVHDYJuQ2qJ
InChI InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2/i7D
InChIKey VAJVDSVGBWFCLW-WHRKIXHSSA-N
Mol Weight 137.2 g/mol
Molecular Formula C9H11DO
Exact Mass 137.095092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOceJ9XAIfZ
Name 3-deutero-3-phenylpropane-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 137.095091751 u
Formula C9H11DO
InChI InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2/i7D
InChIKey VAJVDSVGBWFCLW-WHRKIXHSSA-N
Instrument Name SHIMADZU GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102635
Molecular Weight 137.200 g/mol
Quality 105
Reported Formula C9H11DO
SMILES OCCC([D])C1=CC=CC=C1
SPLASH splash10-014l-7900000000-e5184c5215cf94a394ca
Source of Spectrum QE-27-SM12-12-1 (DOI: 10.1002/chem.202102635)
Wiley ID 1902199