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3-Acetyl-4-(methoxycarbonylmethylthio)indole

View entire compound with spectra: 1 MS (GC)

3-Acetyl-4-(methoxycarbonylmethylthio)indole
SpectraBase Compound ID 8z3lMtvlzbq
InChI InChI=1S/C13H13NO3S/c1-8(15)9-6-14-10-4-3-5-11(13(9)10)18-7-12(16)17-2/h3-6,14H,7H2,1-2H3
InChIKey HCONFRKQHORACX-UHFFFAOYSA-N
Mol Weight 263.31 g/mol
Molecular Formula C13H13NO3S
Exact Mass 263.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUNj6Asbr1a
Name 3-Acetyl-4-(methoxycarbonylmethylthio)indole
Alternate Name(s) Methyl[(3-acetyl-1H-indol-4-yl)sulfanyl]acetate Methyl 2-[(3-acetyl-1H-indol-4-yl)sulfanyl]acetate Methyl 2-[(3-ethanoyl-1H-indol-4-yl)sulfanyl]ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3S
InChI InChI=1S/C13H13NO3S/c1-8(15)9-6-14-10-4-3-5-11(13(9)10)18-7-12(16)17-2/h3-6,14H,7H2,1-2H3
InChIKey HCONFRKQHORACX-UHFFFAOYSA-N
Molecular Weight 263.311 g/mol
SMILES [nH]1c2c(c(c1)C(=O)C)c(ccc2)SCC(=O)OC
SPLASH splash10-03dr-0930000000-ca7966846cf3e397edfc
Source of Spectrum F-47-8633-10
Wiley ID 1266766