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3-Phenyl-1-(trideuteriomethyl)isoquinoline

View entire compound with spectra: 1 MS (GC)

3-Phenyl-1-(trideuteriomethyl)isoquinoline
SpectraBase Compound ID LIkG5AKkBzw
InChI InChI=1S/C16H13N/c1-12-15-10-6-5-9-14(15)11-16(17-12)13-7-3-2-4-8-13/h2-11H,1H3/i1D3
InChIKey ZOXOLPGKTSLTFP-FIBGUPNXSA-N
Mol Weight 222.31 g/mol
Molecular Formula C16H10D3N
Exact Mass 222.12363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zDuDIOsPZs
Name 3-Phenyl-1-(trideuteriomethyl)isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10D3N
InChI InChI=1S/C16H13N/c1-12-15-10-6-5-9-14(15)11-16(17-12)13-7-3-2-4-8-13/h2-11H,1H3/i1D3
InChIKey ZOXOLPGKTSLTFP-FIBGUPNXSA-N
Literature Reference DOI 10.1002/adsc.201101009
Molecular Weight 222.305 g/mol
SMILES c1ccc2cc(nc(c2c1)C([D])([D])[D])-c1ccccc1
SPLASH splash10-00di-3190000000-ae54aaccf1101ce4cce5
Source of Spectrum ASC-354-1890/SM17-4_D3
Wiley ID 1762634