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4-Phenyl-5,6-dihydrobenzo[h]thiochroman-2,3-dicarboxylic anhydride
SpectraBase Compound ID 7xSVR8mNJMN
InChI InChI=1S/C21H16O3S/c22-20-17-16(13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)18(15)25-19(17)21(23)24-20/h1-9,16-17,19H,10-11H2
InChIKey GWXMHQSRSMHQRD-UHFFFAOYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C21H16O3S
Exact Mass 348.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAJzJLcRDG2
Name 4-Phenyl-5,6-dihydrobenzo[h]thiochroman-2,3-dicarboxylic anhydride
Alternate Name(s) 7-phenyl-5,7,7a,10a-tetrahydro-6H-naphtho[2',1':5,6]thiino[2,3-c]furan-8,10-dione
CAS Registry Number 71436-16-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16O3S
InChI InChI=1S/C21H16O3S/c22-20-17-16(13-7-2-1-3-8-13)15-11-10-12-6-4-5-9-14(12)18(15)25-19(17)21(23)24-20/h1-9,16-17,19H,10-11H2
InChIKey GWXMHQSRSMHQRD-UHFFFAOYSA-N
Molecular Weight 348.416 g/mol
SMILES C12C(SC3=C(C2c2ccccc2)CCc2ccccc32)C(=O)OC1=O
SPLASH splash10-0002-0094000000-497bbaea2eb39c34d387
Source of Spectrum J-44-4154-0
Wiley ID 1340757