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2-Methyl 5-(t-Butyl) 3-(benzo[1,3]dioxol-5'-yl)thiophene-2,5-dicarboxylate
SpectraBase Compound ID Zcy4YWYeis
InChI InChI=1S/C18H18O6S/c1-18(2,3)24-16(19)14-8-11(15(25-14)17(20)21-4)10-5-6-12-13(7-10)23-9-22-12/h5-8H,9H2,1-4H3
InChIKey VLLDMBHDLMQKCD-UHFFFAOYSA-N
Mol Weight 362.4 g/mol
Molecular Formula C18H18O6S
Exact Mass 362.082409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoviVb8nGKj
Name 2-Methyl 5-(t-Butyl) 3-(benzo[1,3]dioxol-5'-yl)thiophene-2,5-dicarboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C18H18O6S
InChI InChI=1S/C18H18O6S/c1-18(2,3)24-16(19)14-8-11(15(25-14)17(20)21-4)10-5-6-12-13(7-10)23-9-22-12/h5-8H,9H2,1-4H3
InChIKey VLLDMBHDLMQKCD-UHFFFAOYSA-N
Molecular Weight 362.396 g/mol
SMILES c1(c(cc(s1)C(OC(C)(C)C)=O)-c1cc2OCOc2cc1)C(=O)OC
SPLASH splash10-0a4i-0009000000-91f1f23ba78b4be459e4
Source of Spectrum H-80-535-1
Synonyms 2-Methyl 5-(t-Butyl) 3-(benzo[1,3]dioxol-5-yl)thiophene-2,5-dicarboxylate 5-tert-butyl 2-methyl 3-(1,3-benzodioxol-5-yl)-2,5-thiophenedicarboxylate
Wiley ID 1349426