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Indole-1,3-dicarboxylic acid 1-tert-butyl ester 3-methyl ester
SpectraBase Compound ID A26wRLaYyWA
InChI InChI=1S/C15H17NO4/c1-15(2,3)20-14(18)16-9-11(13(17)19-4)10-7-5-6-8-12(10)16/h5-9H,1-4H3
InChIKey VOWZQOSRBMJMJM-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrgjcBOflqB
Name Indole-1,3-dicarboxylic acid 1-tert-butyl ester 3-methyl ester
Alternate Name(s) 1-O-tert-butyl 3-O-methyl indole-1,3-dicarboxylate O1-tert-butyl O3-methyl indole-1,3-dicarboxylate
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Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-15(2,3)20-14(18)16-9-11(13(17)19-4)10-7-5-6-8-12(10)16/h5-9H,1-4H3
InChIKey VOWZQOSRBMJMJM-UHFFFAOYSA-N
Molecular Weight 275.304 g/mol
SMILES c1(c[n](C(OC(C)(C)C)=O)c2c1cccc2)C(=O)OC
SPLASH splash10-004l-0900000000-deda26ee35d0b52e16f9
Source of Spectrum F-59-753-11
Wiley ID 1676931