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Dimethyl 2,3-bis(4-methylbenzoylthio)succinate
SpectraBase Compound ID 7pMnPORhXO9
InChI InChI=1S/C22H22O6S2/c1-13-5-9-15(10-6-13)21(25)29-17(19(23)27-3)18(20(24)28-4)30-22(26)16-11-7-14(2)8-12-16/h5-12,17-18H,1-4H3
InChIKey SZTLSIJNGKZCBI-UHFFFAOYSA-N
Mol Weight 446.53 g/mol
Molecular Formula C22H22O6S2
Exact Mass 446.085781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRRkopDxK4r
Name Dimethyl 2,3-bis(4-methylbenzoylthio)succinate
Appearance Colorless powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O6S2
InChI InChI=1S/C22H22O6S2/c1-13-5-9-15(10-6-13)21(25)29-17(19(23)27-3)18(20(24)28-4)30-22(26)16-11-7-14(2)8-12-16/h5-12,17-18H,1-4H3
InChIKey SZTLSIJNGKZCBI-UHFFFAOYSA-N
Instrument Name Finnigan Mat 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.d06
Molecular Weight 446.532 g/mol
SMILES COC(C(C(C(=O)OC)SC(c1ccc(C)cc1)=O)SC(c1ccc(cc1)C)=O)=O
SPLASH splash10-014i-0900500000-820ab2d614c57d79a127
Source of Spectrum ARK-2009-72-8b
Wiley ID 1869881