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3-(4-fluorophenyl)-1,4,6-triazatricyclo[6.2.2.0~2,7~]dodec-2(7)-ene-5-thione
SpectraBase Compound ID Hu2z9H3TO8J
InChI InChI=1S/C15H16FN3S/c16-11-3-1-9(2-4-11)12-14-13(18-15(20)17-12)10-5-7-19(14)8-6-10/h1-4,10,12H,5-8H2,(H2,17,18,20)
InChIKey SYWOYULYYTYSIU-UHFFFAOYSA-N
Mol Weight 289.37 g/mol
Molecular Formula C15H16FN3S
Exact Mass 289.104897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZdDwawt7y
Name Pyrido[3,2-d]pyrimidin-2(1H)-thione, 3,4,5,6,7,8-hexahydro-5,8-ethano-4-(4-fluorophenyl)-
CAS Registry Number 294877-21-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16FN3S
InChI InChI=1S/C15H16FN3S/c16-11-3-1-9(2-4-11)12-14-13(18-15(20)17-12)10-5-7-19(14)8-6-10/h1-4,10,12H,5-8H2,(H2,17,18,20)
InChIKey SYWOYULYYTYSIU-UHFFFAOYSA-N
Molecular Weight 289.372 g/mol
SMILES N1C(NC(C2=C1C1CCN2CC1)c1ccc(cc1)F)=S
SPLASH splash10-000i-1590000000-c3b55e65f9e5b8d9dac3
Source of Spectrum AD-0-2532-0
Wiley ID 1426565