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7-(3-hydroxypropoxy)-4-methyl-1H-indole-2,5-dicarboxylic acid dimethyl ester

View entire compound with spectra: 1 MS (GC)

7-(3-hydroxypropoxy)-4-methyl-1H-indole-2,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID LZv35Ahce8J
InChI InChI=1S/C16H19NO6/c1-9-10-7-12(16(20)22-3)17-14(10)13(23-6-4-5-18)8-11(9)15(19)21-2/h7-8,17-18H,4-6H2,1-3H3
InChIKey DFTPMXRUDHECRJ-UHFFFAOYSA-N
Mol Weight 321.33 g/mol
Molecular Formula C16H19NO6
Exact Mass 321.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uPZbr8xz0z
Name 7-(3-hydroxypropoxy)-4-methyl-1H-indole-2,5-dicarboxylic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO6
InChI InChI=1S/C16H19NO6/c1-9-10-7-12(16(20)22-3)17-14(10)13(23-6-4-5-18)8-11(9)15(19)21-2/h7-8,17-18H,4-6H2,1-3H3
InChIKey DFTPMXRUDHECRJ-UHFFFAOYSA-N
Molecular Weight 321.329 g/mol
SMILES [nH]1c(cc2c1c(OCCCO)cc(c2C)C(=O)OC)C(=O)OC
SPLASH splash10-0089-3097000000-af4fd5176a206c83c9a5
Source of Spectrum E1-46-565-19
Synonyms Dimethyl 4-methyl-7-(3-oxidanylpropoxy)-1H-indole-2,5-dicarboxylate Dimethyl 7-(3-hydroxypropoxy)-4-methyl-1H-indole-2,5-dicarboxylate
Wiley ID 1554270