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(3R,3aR,7aR)-1-[(4-methoxyphenyl)methyl]-2-oxo-3a,6,7,7a-tetrahydro-3H-indole-3-carboxylic acid methyl ester
SpectraBase Compound ID JBYhL6FXj7r
InChI InChI=1S/C18H21NO4/c1-22-13-9-7-12(8-10-13)11-19-15-6-4-3-5-14(15)16(17(19)20)18(21)23-2/h3,5,7-10,14-16H,4,6,11H2,1-2H3/t14-,15+,16+/m0/s1
InChIKey LNIGHBRCHPPUTA-ARFHVFGLSA-N
Mol Weight 315.37 g/mol
Molecular Formula C18H21NO4
Exact Mass 315.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBlyQYe9ejH
Name (3R,3aR,7aR)-1-[(4-methoxyphenyl)methyl]-2-oxo-3a,6,7,7a-tetrahydro-3H-indole-3-carboxylic acid methyl ester
Alternate Name(s) (3R,3aR,7aR)-2-keto-1-p-anisyl-3a,6,7,7a-tetrahydro-3H-indole-3-carboxylic acid methyl ester Methyl (3R,3aR,7aR)-1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-3a,6,7,7a-tetrahydro-3H-indole-3-carboxylate Methyl (3R,3aR,7aR)-1-[(4-methoxyphenyl)methyl]-2-oxo-3a,6,7,7a-tetrahydro-3H-indole-3-carboxylate
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Formula C18H21NO4
InChI InChI=1S/C18H21NO4/c1-22-13-9-7-12(8-10-13)11-19-15-6-4-3-5-14(15)16(17(19)20)18(21)23-2/h3,5,7-10,14-16H,4,6,11H2,1-2H3/t14-,15+,16+/m0/s1
InChIKey LNIGHBRCHPPUTA-ARFHVFGLSA-N
Molecular Weight 315.369 g/mol
SMILES C1(N([C@@]2(CCC=C[C@@]2([C@]1(C(=O)OC)[H])[H])[H])Cc1ccc(cc1)OC)=O
SPLASH splash10-00di-0901000000-cb898b0b238732d805be
Source of Spectrum K1-2004-2845-7
Wiley ID 1561096