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1-Amino-6,7,8,9-tetrahydro-5-methyl-N-[3-(trifluoromethyl)phenyl]thieno[2,3-c]isoquinoline-2-carboxamide
SpectraBase Compound ID 4dECvN1guGE
InChI InChI=1S/C20H18F3N3OS/c1-10-13-7-2-3-8-14(13)15-16(24)17(28-19(15)25-10)18(27)26-12-6-4-5-11(9-12)20(21,22)23/h4-6,9H,2-3,7-8,24H2,1H3,(H,26,27)
InChIKey BYNMLKQKZWNZAZ-UHFFFAOYSA-N
Mol Weight 405.44 g/mol
Molecular Formula C20H18F3N3OS
Exact Mass 405.112268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ptymqx2C2p
Name 1-AMINO-6,7,8,9-TETRAHYDRO-5-METHYL-N-[3-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18F3N3OS
InChI InChI=1S/C20H18F3N3OS/c1-10-13-7-2-3-8-14(13)15-16(24)17(28-19(15)25-10)18(27)26-12-6-4-5-11(9-12)20(21,22)23/h4-6,9H,2-3,7-8,24H2,1H3,(H,26,27)
InChIKey BYNMLKQKZWNZAZ-UHFFFAOYSA-N
Molecular Weight 405.1119
SMILES N(c1cccc(C(F)(F)F)c1)C(c1c(N)c2c3CCCCc3c(nc2s1)C)=O
SPLASH splash10-0002-4590100000-b1d93b5134bded8243e2
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany