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(2S,3aS,7aR)-2,3,3a,4,7,7a-Hexahydroindol-1,2-dicarboxylic acid -1-tert-butyl ester 2-methyl ester
SpectraBase Compound ID ECJRaoCtJwR
InChI InChI=1S/C15H23NO4/c1-15(2,3)20-14(18)16-11-8-6-5-7-10(11)9-12(16)13(17)19-4/h5-6,10-12H,7-9H2,1-4H3/t10-,11+,12-/m0/s1
InChIKey OZGDZHRWGJXMIT-TUAOUCFPSA-N
Mol Weight 281.35 g/mol
Molecular Formula C15H23NO4
Exact Mass 281.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4gUlQnZ4tc
Name (2S,3aS,7aR)-2,3,3a,4,7,7a-Hexahydroindol-1,2-dicarboxylic acid -1-tert-butyl ester 2-methyl ester
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Formula C15H23NO4
InChI InChI=1S/C15H23NO4/c1-15(2,3)20-14(18)16-11-8-6-5-7-10(11)9-12(16)13(17)19-4/h5-6,10-12H,7-9H2,1-4H3/t10-,11+,12-/m0/s1
InChIKey OZGDZHRWGJXMIT-TUAOUCFPSA-N
Molecular Weight 281.352 g/mol
SMILES C(N1[C@@](C[C@]2([C@]1(CC=CC2)[H])[H])(C(=O)OC)[H])(OC(C)(C)C)=O
SPLASH splash10-01di-3930000000-dbd50f971cfb9f45128b
Source of Spectrum KC-57-6469-12
Synonyms 1-tert-Butyl 2-methyl (2S,3aS,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indole-1,2-dicarboxylate trans-(2S,3aS,7aS)/(2S,3aS,7aR)-2,3,3a,4,7,7a-Hexahydroindol-1,2-dicarboxylic acid -1-tert-butyl ester 2-methyl ester
Wiley ID 1625152