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5,11-Dihydro-5-methyl-1,4-bis(trifluoromethyl)pyridazino[4,5-c][1,5]benzothiazepine
SpectraBase Compound ID 6JqK2ca4zp5
InChI InChI=1S/C14H9F6N3S/c1-23-8-4-2-3-5-9(8)24-6-7-10(23)12(14(18,19)20)22-21-11(7)13(15,16)17/h2-5H,6H2,1H3
InChIKey YKYSNNWGEZCSPR-UHFFFAOYSA-N
Mol Weight 365.3 g/mol
Molecular Formula C14H9F6N3S
Exact Mass 365.042137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1fvXPmhFCm
Name 5,11-Dihydro-5-methyl-1,4-bis(trifluoromethyl)pyridazino[4,5-c][1,5]benzothiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9F6N3S
InChI InChI=1S/C14H9F6N3S/c1-23-8-4-2-3-5-9(8)24-6-7-10(23)12(14(18,19)20)22-21-11(7)13(15,16)17/h2-5H,6H2,1H3
InChIKey YKYSNNWGEZCSPR-UHFFFAOYSA-N
Molecular Weight 365.297 g/mol
SMILES C1Sc2c(N(c3c1c(nnc3C(F)(F)F)C(F)(F)F)C)cccc2
SPLASH splash10-0gb9-0369000000-2444bbee204aff8c9f21
Source of Spectrum H1-43-1975-16
Synonyms 5-Methyl-1,4-bis(trifluoromethyl)-5,11-dihydropyridazino[4,5-c][1,5]benzothiazepine
Wiley ID 757952