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N-(2-methylbenzyl)-2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
SpectraBase Compound ID IxxVF05R6aM
InChI InChI=1S/C18H16F3N3S/c1-10-5-2-3-6-11(10)9-22-15-14-12-7-4-8-13(12)25-16(14)24-17(23-15)18(19,20)21/h2-3,5-6H,4,7-9H2,1H3,(H,22,23,24)
InChIKey XACUOYVXYFDIPL-UHFFFAOYSA-N
Mol Weight 363.4 g/mol
Molecular Formula C18H16F3N3S
Exact Mass 363.101703 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GO6c8f5nYuG
Name N-(2-methylbenzyl)-2-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F3N3S
InChI InChI=1S/C18H16F3N3S/c1-10-5-2-3-6-11(10)9-22-15-14-12-7-4-8-13(12)25-16(14)24-17(23-15)18(19,20)21/h2-3,5-6H,4,7-9H2,1H3,(H,22,23,24)
InChIKey XACUOYVXYFDIPL-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.cclet.2014.05.043
Molecular Weight 363.402 g/mol
SMILES N(c1nc(C(F)(F)F)nc2sc3CCCc3c12)Cc1c(cccc1)C
SPLASH splash10-0a4i-0904000000-c3915f39350f207315e1
Source of Spectrum CCL-25-1008-3f
Wiley ID 1743771