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4-Chloro-3-(N-4-chloro-phenyliminomethyl)(2H)thiobenzopyran
SpectraBase Compound ID 5kyJkUpyooB
InChI InChI=1S/C16H11Cl2NS/c17-12-5-7-13(8-6-12)19-9-11-10-20-15-4-2-1-3-14(15)16(11)18/h1-9H,10H2/b19-9+
InChIKey WSOQZKQCGCVGSF-DJKKODMXSA-N
Mol Weight 320.24 g/mol
Molecular Formula C16H11Cl2NS
Exact Mass 318.998926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72xwTFWrqAK
Name 4-Chloro-3-(N-4-chloro-phenyliminomethyl)(2H)thiobenzopyran
Alternate Name(s) 4-Chloro-N-[(E)-(4-Chloro-2H-thiochromen-3-yl)methylidene]aniline
CAS Registry Number 87591-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11Cl2NS
InChI InChI=1S/C16H11Cl2NS/c17-12-5-7-13(8-6-12)19-9-11-10-20-15-4-2-1-3-14(15)16(11)18/h1-9H,10H2/b19-9+
InChIKey WSOQZKQCGCVGSF-DJKKODMXSA-N
Molecular Weight 320.237 g/mol
SMILES C1(=C(\C=N\c2ccc(cc2)Cl)CSc2c1cccc2)Cl
SPLASH splash10-001i-0297000000-dbe13d465639c388b685
Source of Spectrum O-22-18-12
Wiley ID 1319236