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5,6,7,8-tetradeuterioquinoline
SpectraBase Compound ID KbtoPTSpEHS
InChI InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H/i1D,2D,4D,6D
InChIKey SMWDFEZZVXVKRB-QSHLYVKESA-N
Mol Weight 133.19 g/mol
Molecular Formula C9H3D4N
Exact Mass 133.082956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8N5HYSmbsEN
Name 5,6,7,8-tetradeuterioquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H3D4N
GC Oven Program Oven temp 250 oC
InChI InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H/i1D,2D,4D,6D
InChIKey SMWDFEZZVXVKRB-QSHLYVKESA-N
Instrument Name HP 5890 GC-5970 MSD
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.0c00945
Molecular Weight 133.186 g/mol
SMILES c1(c(c2c(c(c1[D])[D])nccc2)[D])[D]
SPLASH splash10-001i-3900000000-94d6a9b716a8d47403af
Source of Spectrum G4-84-528-Figure 2B
Wiley ID 1884132