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([1,1'-biphenyl]-4-yl-2',3',4',5',6'-d5)methanol

View entire compound with spectra: 1 MS (GC)

([1,1'-biphenyl]-4-yl-2',3',4',5',6'-d5)methanol
SpectraBase Compound ID 1SO5eGUKMHV
InChI InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2/i1D,2D,3D,4D,5D
InChIKey AXCHZLOJGKSWLV-RALIUCGRSA-N
Mol Weight 189.27 g/mol
Molecular Formula C13H7D5O
Exact Mass 189.120199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1M9tU5xmSzY
Name ([1,1'-biphenyl]-4-yl-2',3',4',5',6'-d5)methanol
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 189.120198735 u
Formula C13H7D5O
InChI InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2/i1D,2D,3D,4D,5D
InChIKey AXCHZLOJGKSWLV-RALIUCGRSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202108814
Molecular Weight 189.269 g/mol
Quality 1000
SMILES OCC1=CC=C(C=C1)C1=C(C(=C(C(=C1[D])[D])[D])[D])[D]
SPLASH splash10-01p9-1900000000-551dfd0ae46f23960cfe
Source of Spectrum ACI-60-SM68-9c (DOI: 10.1002/anie.202108814)
Thin-Layer Chromatography 0.56 (ethyl acetate/cyclohexane, 1:1)
Wiley ID 1891337