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1,3-bis(4-thiadiazolyl)propane-1,2,2,3-tetracarboxylic acid tetramethyl ester
SpectraBase Compound ID 6q9tjAXPCZX
InChI InChI=1S/C15H16N4O8S2/c1-24-11(20)9(7-5-28-18-16-7)15(13(22)26-3,14(23)27-4)10(12(21)25-2)8-6-29-19-17-8/h5-6,9-10H,1-4H3
InChIKey WOQLHOWODYBYEK-UHFFFAOYSA-N
Mol Weight 444.43 g/mol
Molecular Formula C15H16N4O8S2
Exact Mass 444.040956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmZnKIDaJcR
Name 1,3-bis(4-thiadiazolyl)propane-1,2,2,3-tetracarboxylic acid tetramethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C15H16N4O8S2
InChI InChI=1S/C15H16N4O8S2/c1-24-11(20)9(7-5-28-18-16-7)15(13(22)26-3,14(23)27-4)10(12(21)25-2)8-6-29-19-17-8/h5-6,9-10H,1-4H3
InChIKey WOQLHOWODYBYEK-UHFFFAOYSA-N
Molecular Weight 444.433 g/mol
SMILES C(C(C(C(=O)OC)c1nnsc1)(C(=O)OC)C(=O)OC)(C(=O)OC)c1nnsc1
SPLASH splash10-001i-0009300000-33fb8650d0f01f1f332d
Source of Spectrum F-68-1952-13
Synonyms 1,3-bis(thiadiazol-4-yl)propane-1,2,2,3-tetracarboxylic acid tetramethyl ester tetramethyl 1,3-bis(1,2,3-thiadiazol-4-yl)propane-1,2,2,3-tetracarboxylate tetramethyl 1,3-bis(thiadiazol-4-yl)propane-1,2,2,3-tetracarboxylate
Wiley ID 1571950