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Ethyl 5-(acetyloxy)-1-benzyl-6-bromo-2-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID LyUDRGu6tlp
InChI InChI=1S/C21H20BrNO4/c1-4-26-21(25)20-13(2)23(12-15-8-6-5-7-9-15)18-11-17(22)19(10-16(18)20)27-14(3)24/h5-11H,4,12H2,1-3H3
InChIKey RKKXDBXPBMUKMA-UHFFFAOYSA-N
Mol Weight 430.3 g/mol
Molecular Formula C21H20BrNO4
Exact Mass 429.057571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AteP9HPiJyX
Name Ethyl 5-(acetyloxy)-1-benzyl-6-bromo-2-methyl-1H-indole-3-carboxylate
CAS Registry Number 300860-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20BrNO4
InChI InChI=1S/C21H20BrNO4/c1-4-26-21(25)20-13(2)23(12-15-8-6-5-7-9-15)18-11-17(22)19(10-16(18)20)27-14(3)24/h5-11H,4,12H2,1-3H3
InChIKey RKKXDBXPBMUKMA-UHFFFAOYSA-N
Molecular Weight 430.298 g/mol
SMILES c1(c([n](Cc2ccccc2)c2c1cc(c(Br)c2)OC(=O)C)C)C(=O)OCC
SPLASH splash10-000i-3009200000-4c716b2a997295b2081d
Source of Spectrum AD-0-2532-0
Synonyms 5-Acetoxy-1-benzyl-6-bromo-2-methyl-indole-3-carboxylic acid ethyl ester 5-Acetyloxy-6-bromo-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester Ethyl 5-acetoxy-1-benzyl-6-bromo-2-methyl-indole-3-carboxylate Ethyl 5-acetyloxy-1-benzyl-6-bromo-2-methylindole-3-carboxylate Ethyl 5-acetyloxy-6-bromanyl-2-methyl-1-(phenylmethyl)indole-3-carboxylate Indole-3-carboxylic acid, 5-acetoxy-1-benzyl-6-bromo-2-methyl-, ethyl ester
Wiley ID 1432894