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7-ethyl-3-methyl-9-(4-chlorobenzyl-idene)-5-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-pyrido[4,3-d]thiazolo[3,2-a]pyramidines
SpectraBase Compound ID 53jaLcktRRn
InChI InChI=1S/C25H23Cl2N3S/c1-3-29-13-19(12-17-4-8-20(26)9-5-17)23-22(14-29)24(18-6-10-21(27)11-7-18)30-16(2)15-31-25(30)28-23/h4-12,15,24H,3,13-14H2,1-2H3/b19-12+
InChIKey SSVUPJDKVCRZOS-XDHOZWIPSA-N
Mol Weight 468.45 g/mol
Molecular Formula C25H23Cl2N3S
Exact Mass 467.098974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4RcRcmmrvA
Name 7-ethyl-3-methyl-9-(4-chlorobenzyl-idene)-5-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-pyrido[4,3-d]thiazolo[3,2-a]pyramidines
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23Cl2N3S
InChI InChI=1S/C25H23Cl2N3S/c1-3-29-13-19(12-17-4-8-20(26)9-5-17)23-22(14-29)24(18-6-10-21(27)11-7-18)30-16(2)15-31-25(30)28-23/h4-12,15,24H,3,13-14H2,1-2H3/b19-12+
InChIKey SSVUPJDKVCRZOS-XDHOZWIPSA-N
Molecular Weight 468.446 g/mol
SMILES C12=C(N=C3SC=C(N3C2c2ccc(cc2)Cl)C)\C(=C\c2ccc(cc2)Cl)CN(C1)CC
SPLASH splash10-014i-0000900000-0e379ee0bad96ae3af20
Source of Spectrum F2-47-71-37
Wiley ID 1706184