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4-(p-Chlorophenyl)-5,6-dihydrobenzo[h]thiochroman-2,3-dicarboxylic anhydride
SpectraBase Compound ID 4kZIF3yTHwU
InChI InChI=1S/C21H15ClO3S/c22-13-8-5-12(6-9-13)16-15-10-7-11-3-1-2-4-14(11)18(15)26-19-17(16)20(23)25-21(19)24/h1-6,8-9,16-17,19H,7,10H2
InChIKey PDZKQGCGQHZYAW-UHFFFAOYSA-N
Mol Weight 382.86 g/mol
Molecular Formula C21H15ClO3S
Exact Mass 382.043043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpLFj75bErm
Name 4-(p-Chlorophenyl)-5,6-dihydrobenzo[h]thiochroman-2,3-dicarboxylic anhydride
Alternate Name(s) 7-(4-Chlorophenyl)-5,7,7a,10a-tetrahydro-6H-naphtho[2',1':5,6]thiino[2,3-c]furan-8,10-dione
CAS Registry Number 71436-18-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClO3S
InChI InChI=1S/C21H15ClO3S/c22-13-8-5-12(6-9-13)16-15-10-7-11-3-1-2-4-14(11)18(15)26-19-17(16)20(23)25-21(19)24/h1-6,8-9,16-17,19H,7,10H2
InChIKey PDZKQGCGQHZYAW-UHFFFAOYSA-N
Molecular Weight 382.861 g/mol
SMILES C12C(SC3=C(C2c2ccc(cc2)Cl)CCc2ccccc32)C(=O)OC1=O
SPLASH splash10-001j-0094000000-c9d9f06e76dbb3bfdc9b
Source of Spectrum J-44-4155-0
Wiley ID 1360522