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9-Methoxy-2,3,5,6-tetrahydrobenzo[f][1,4]benzodithiin
SpectraBase Compound ID CGWYZ5RZge7
InChI InChI=1S/C13H14OS2/c1-14-10-4-2-9-3-5-12-13(11(9)8-10)16-7-6-15-12/h2,4,8H,3,5-7H2,1H3
InChIKey PVTYCXHOKPJMKF-UHFFFAOYSA-N
Mol Weight 250.37 g/mol
Molecular Formula C13H14OS2
Exact Mass 250.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1Bxu48cxxm
Name 9-Methoxy-2,3,5,6-tetrahydrobenzo[f][1,4]benzodithiin
CAS Registry Number 136545-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14OS2
InChI InChI=1S/C13H14OS2/c1-14-10-4-2-9-3-5-12-13(11(9)8-10)16-7-6-15-12/h2,4,8H,3,5-7H2,1H3
InChIKey PVTYCXHOKPJMKF-UHFFFAOYSA-N
Molecular Weight 250.374 g/mol
SMILES C=12c3c(ccc(c3)OC)CCC1SCCS2
SPLASH splash10-0udi-0190000000-63aeed467345e4ad79fd
Source of Spectrum J-56-6751-4
Synonyms 9-Methoxy-2,3,5,6-tetrahydrobenzo[f][1,4]benzodithiine
Wiley ID 1253045