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2,6-N,N'-pyridilen-bis-1-chloro-benzo[b]thiophene-2-carboxamide
SpectraBase Compound ID Kch4KKk4RN8
InChI InChI=1S/C23H13Cl2N3O2S2/c24-18-12-6-1-3-8-14(12)31-20(18)22(29)27-16-10-5-11-17(26-16)28-23(30)21-19(25)13-7-2-4-9-15(13)32-21/h1-11H,(H2,26,27,28,29,30)
InChIKey WQNOJGVQEYGRIF-UHFFFAOYSA-N
Mol Weight 498.4 g/mol
Molecular Formula C23H13Cl2N3O2S2
Exact Mass 496.982624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnUbKpO1zeP
Name 2,6-N,N'-pyridilen-bis-1-chloro-benzo[b]thiophene-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H13Cl2N3O2S2
InChI InChI=1S/C23H13Cl2N3O2S2/c24-18-12-6-1-3-8-14(12)31-20(18)22(29)27-16-10-5-11-17(26-16)28-23(30)21-19(25)13-7-2-4-9-15(13)32-21/h1-11H,(H2,26,27,28,29,30)
InChIKey WQNOJGVQEYGRIF-UHFFFAOYSA-N
Instrument Name Shimadzu QP-5000
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290091208
Molecular Weight 498.402 g/mol
SMILES N(C(c1c(c2c(cccc2)s1)Cl)=O)c1cccc(n1)NC(=O)c1sc2ccccc2c1Cl
SPLASH splash10-0002-0900000000-c5a33547904c5b29017d
Source of Spectrum RCM-9-1120-3
Wiley ID 1835789