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S-Benzyl 2-amino-4-chlorobenzothioate
SpectraBase Compound ID LR6LdYZdnXW
InChI InChI=1S/C14H12ClNOS/c15-11-6-7-12(13(16)8-11)14(17)18-9-10-4-2-1-3-5-10/h1-8H,9,16H2
InChIKey ISCBSVIGWAJEPR-UHFFFAOYSA-N
Mol Weight 277.77 g/mol
Molecular Formula C14H12ClNOS
Exact Mass 277.032813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wIqcETkpMQ
Name S-Benzyl 2-amino-4-chlorobenzothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClNOS
InChI InChI=1S/C14H12ClNOS/c15-11-6-7-12(13(16)8-11)14(17)18-9-10-4-2-1-3-5-10/h1-8H,9,16H2
InChIKey ISCBSVIGWAJEPR-UHFFFAOYSA-N
Molecular Weight 277.769 g/mol
SMILES Nc1c(C(SCc2ccccc2)=O)ccc(Cl)c1
SPLASH splash10-0udi-1920000000-754ee34580e08149ea7c
Source of Spectrum F-69-2297-3dg
Wiley ID 1737742