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4-Chloro-7-trifluoromethylquinoline-3-d
SpectraBase Compound ID BxK493zCcqs
InChI InChI=1S/C10H5ClF3N/c11-8-3-4-15-9-5-6(10(12,13)14)1-2-7(8)9/h1-5H/i3D
InChIKey LLRQVSZVVAKRJA-WFVSFCRTSA-N
Mol Weight 232.61 g/mol
Molecular Formula C10H4DClF3N
Exact Mass 232.012538 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bBxExOmcae
Name 4-Chloro-7-trifluoromethylquinoline-3-d
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.012538100 u
Formula C10H4DClF3N
InChI InChI=1S/C10H5ClF3N/c11-8-3-4-15-9-5-6(10(12,13)14)1-2-7(8)9/h1-5H/i3D
InChIKey LLRQVSZVVAKRJA-WFVSFCRTSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200204
Molecular Weight 232.611 g/mol
Quality 535
SMILES C1(=C(C=2C=CC(C(F)(F)F)=CC2N=C1)Cl)[D]
SPLASH splash10-001j-5950000000-b6bb0174a665dd888a1e
Source of Spectrum K1-2022-SM90-20 (DOI: 10.1002/ejoc.202200204)
Wiley ID 1910371