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10,12-Diamino-7-(4-fluorophenyl)-6,6a,7,8-tetrahydro-5H-naphtho[1,2-e]pyrimido[4,5-b][1,4]diazepine
SpectraBase Compound ID 3O6b3BrmXQz
InChI InChI=1S/C21H19FN6/c22-13-8-5-12(6-9-13)16-15-10-7-11-3-1-2-4-14(11)17(15)25-18-19(23)27-21(24)28-20(18)26-16/h1-6,8-9,15-16H,7,10H2,(H5,23,24,26,27,28)
InChIKey DNVQIUSHIPXGAR-UHFFFAOYSA-N
Mol Weight 374.42 g/mol
Molecular Formula C21H19FN6
Exact Mass 374.165523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3lmv6J961l
Name 10,12-Diamino-7-(4-fluorophenyl)-6,6a,7,8-tetrahydro-5H-naphtho[1,2-e]pyrimido[4,5-b][1,4]diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19FN6
InChI InChI=1S/C21H19FN6/c22-13-8-5-12(6-9-13)16-15-10-7-11-3-1-2-4-14(11)17(15)25-18-19(23)27-21(24)28-20(18)26-16/h1-6,8-9,15-16H,7,10H2,(H5,23,24,26,27,28)
InChIKey DNVQIUSHIPXGAR-UHFFFAOYSA-N
Molecular Weight 374.423 g/mol
SMILES N1C(C2C(=Nc3c1nc(nc3N)N)c1c(CC2)cccc1)c1ccc(cc1)F
SPLASH splash10-00di-0029000000-c6b427b97995005c7b5f
Source of Spectrum F2-45-2845-5c
Wiley ID 1689242