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1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile
SpectraBase Compound ID 8D26yIKqpOj
InChI InChI=1S/C14H9Cl2F3N4/c15-9-4-7(14(17,18)19)5-10(16)12(9)23-13-8(2-1-3-21-13)11(6-20)22-23/h4-5,21H,1-3H2
InChIKey YATFXKCSHYALFS-UHFFFAOYSA-N
Mol Weight 361.16 g/mol
Molecular Formula C14H9Cl2F3N4
Exact Mass 360.015636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IMgJI1aJjz
Name 1-(2,6-Dichloro-4-(trifluoromethyl)phenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9Cl2F3N4
InChI InChI=1S/C14H9Cl2F3N4/c15-9-4-7(14(17,18)19)5-10(16)12(9)23-13-8(2-1-3-21-13)11(6-20)22-23/h4-5,21H,1-3H2
InChIKey YATFXKCSHYALFS-UHFFFAOYSA-N
Instrument Name MicroMass GCT CA 055
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.224
Molecular Weight 361.155 g/mol
Reported Formula C14H9F3Cl2N4
SMILES N1CCCc2c1[n](nc2C#N)-c1c(cc(cc1Cl)C(F)(F)F)Cl
SPLASH splash10-03di-0249000000-c6d15de9854c0a65bedd
Source of Spectrum ARK-2009-264-14
Wiley ID 1866618