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6,6a,12a,13-tetrahydroanthra[2,3-b]benzo[d]thiophene-7,12-dione
SpectraBase Compound ID Kv9SFxeQ7t1
InChI InChI=1S/C20H14O2S/c21-19-12-6-1-2-7-13(12)20(22)16-10-18-14(9-15(16)19)11-5-3-4-8-17(11)23-18/h1-8,15-16H,9-10H2
InChIKey HXCHTUJRJXMNHK-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C20H14O2S
Exact Mass 318.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gloORKKcXr
Name 6,6a,12a,13-tetrahydroanthra[2,3-b]benzo[d]thiophene-7,12-dione
Alternate Name(s) 6,6a,12a,13-tetrahydroanthra[2,3-b][1]benzothiophene-7,12-dione
CAS Registry Number 113354-61-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14O2S
InChI InChI=1S/C20H14O2S/c21-19-12-6-1-2-7-13(12)20(22)16-10-18-14(9-15(16)19)11-5-3-4-8-17(11)23-18/h1-8,15-16H,9-10H2
InChIKey HXCHTUJRJXMNHK-UHFFFAOYSA-N
Molecular Weight 318.390 g/mol
SMILES c12c(CC3C(C2)C(c2c(cccc2)C3=O)=O)c2ccccc2s1
SPLASH splash10-0gb9-0109000000-b80195400a5e7e64978f
Source of Spectrum K-121-1205-11
Wiley ID 1318685