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3-cyano-2-{[4-(dimethylamino)phenyl]imino}-1,1-difluoro-1H,2H-2l5-[1,3,2]diazaborolo[3,4-a]quinolin-2-ylium-1-uide
SpectraBase Compound ID CPcymD2cVh7
InChI InChI=1S/C19H16BF2N5/c1-25(2)16-10-8-15(9-11-16)24-27-19(13-23)18-12-7-14-5-3-4-6-17(14)26(18)20(27,21)22/h3-12H,1-2H3
InChIKey XKPZVPGOSLKHNR-UHFFFAOYSA-N
Mol Weight 363.2 g/mol
Molecular Formula C19H16BF2N5
Exact Mass 363.146682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYGhFtl4Dby
Name 3-cyano-2-{[4-(dimethylamino)phenyl]imino}-1,1-difluoro-1H,2H-2l5-[1,3,2]diazaborolo[3,4-a]quinolin-2-ylium-1-uide
Appearance Green powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16BF2N5
InChI InChI=1S/C19H16BF2N5/c1-25(2)16-10-8-15(9-11-16)24-27-19(13-23)18-12-7-14-5-3-4-6-17(14)26(18)20(27,21)22/h3-12H,1-2H3
InChIKey XKPZVPGOSLKHNR-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010Plus
Ionization Type EI
Molecular Weight 363.179 g/mol
SMILES c1(N=[N+]2[B-](F)(F)N3C(=C2C#N)C=Cc2c3cccc2)ccc(cc1)N(C)C
SPLASH splash10-001i-1901000000-220c25e6ca66fbc32214
Source of Spectrum WO2015031518A1
Wiley ID 1850534