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Isoquinolin-4-yl(phenyl)methanol
SpectraBase Compound ID 7a96Qg3bODo
InChI InChI=1S/C16H13NO/c18-16(12-6-2-1-3-7-12)15-11-17-10-13-8-4-5-9-14(13)15/h1-11,16,18H
InChIKey SKILENITSFDCPU-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C16H13NO
Exact Mass 235.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRL9Y5OMBOy
Name Isoquinolin-4-yl(phenyl)methanol
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.099714042 u
Formula C16H13NO
GC Column HP1 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C16H13NO/c18-16(12-6-2-1-3-7-12)15-11-17-10-13-8-4-5-9-14(13)15/h1-11,16,18H
InChIKey SKILENITSFDCPU-UHFFFAOYSA-N
Instrument Name HP 5995C model
Ionization Type EI
Literature Reference DOI 10.1002/anie.202304720
Molecular Weight 235.286 g/mol
Quality 143
Reported Formula C16H13NO
SMILES OC(C1=CN=CC2=C1C=CC=C2)C1=CC=CC=C1
SPLASH splash10-001i-2920000000-5bb674c5b7eabe4f03c3
Source of Spectrum ACI-62-SM18-4y (DOI: 10.1002/anie.202304720)
Wiley ID 1911175