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1H-Indole-3-acetic acid, 1-acetyl-5-(acetyloxy)-, methyl ester
SpectraBase Compound ID CEUiHREnKuv
InChI InChI=1S/C15H15NO5/c1-9(17)16-8-11(6-15(19)20-3)13-7-12(21-10(2)18)4-5-14(13)16/h4-5,7-8H,6H2,1-3H3
InChIKey NMCRSWFEHJMDCE-UHFFFAOYSA-N
Mol Weight 289.29 g/mol
Molecular Formula C15H15NO5
Exact Mass 289.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2weGVk2XSHu
Name 1H-Indole-3-acetic acid, 1-acetyl-5-(acetyloxy)-, methyl ester
CAS Registry Number 55125-16-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO5
InChI InChI=1S/C15H15NO5/c1-9(17)16-8-11(6-15(19)20-3)13-7-12(21-10(2)18)4-5-14(13)16/h4-5,7-8H,6H2,1-3H3
InChIKey NMCRSWFEHJMDCE-UHFFFAOYSA-N
Molecular Weight 289.287 g/mol
SMILES CC([n]1cc(CC(=O)OC)c2cc(ccc12)OC(C)=O)=O
SPLASH splash10-0002-6970000000-c5e5f56fa8c3b3dc5e33
Source of Spectrum AD-0-5054-0
Synonyms Methyl [1-acetyl-5-(acetyloxy)-1H-indol-3-yl]acetate 2-(1-acetyl-5-acetyloxy-3-indolyl)acetic acid methyl ester 2-(5-acetoxy-1-acetyl-indol-3-yl)acetic acid methyl ester Methyl 2-(1-acetyl-5-acetyloxyindol-3-yl)acetate Methyl 2-(5-acetoxy-1-acetyl-indol-3-yl)acetate Methyl 2-(5-acetyloxy-1-ethanoyl-indol-3-yl)ethanoate
Wiley ID 42587