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4-Methyldibenzothiophene-2,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8FyhBeDoTjB
InChI InChI=1S/C17H14O4S/c1-9-14(17(19)21-3)12(16(18)20-2)8-11-10-6-4-5-7-13(10)22-15(9)11/h4-8H,1-3H3
InChIKey WLNYYMYUCLFFBF-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C17H14O4S
Exact Mass 314.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQ2CZlqo4nW
Name 4-Methyldibenzothiophene-2,3-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-methyldibenzothiophene-2,3-dicarboxylate
CAS Registry Number 120571-73-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O4S
InChI InChI=1S/C17H14O4S/c1-9-14(17(19)21-3)12(16(18)20-2)8-11-10-6-4-5-7-13(10)22-15(9)11/h4-8H,1-3H3
InChIKey WLNYYMYUCLFFBF-UHFFFAOYSA-N
Molecular Weight 314.355 g/mol
SMILES c12c(cc(c(c2C)C(=O)OC)C(=O)OC)c2ccccc2s1
SPLASH splash10-01q9-0194000000-03e29ae08421ad2f5d87
Source of Spectrum KC-1990-687-19
Wiley ID 1314952