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1H-Indole, 1-acetyl-5-methyl-2-[(methylsulfonyl)methyl]-
SpectraBase Compound ID KK9YmOXcoHw
InChI InChI=1S/C13H15NO3S/c1-9-4-5-13-11(6-9)7-12(8-18(3,16)17)14(13)10(2)15/h4-7H,8H2,1-3H3
InChIKey QVILLDJGWYKARP-UHFFFAOYSA-N
Mol Weight 265.33 g/mol
Molecular Formula C13H15NO3S
Exact Mass 265.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IakAy3UQjxP
Name 1H-Indole, 1-acetyl-5-methyl-2-[(methylsulfonyl)methyl]-
CAS Registry Number 104737-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3S
InChI InChI=1S/C13H15NO3S/c1-9-4-5-13-11(6-9)7-12(8-18(3,16)17)14(13)10(2)15/h4-7H,8H2,1-3H3
InChIKey QVILLDJGWYKARP-UHFFFAOYSA-N
Molecular Weight 265.327 g/mol
SMILES c1([n](c2c(c1)cc(cc2)C)C(=O)C)CS(=O)(=O)C
SPLASH splash10-0002-0900000000-25b977e5f69564eed67c
Source of Spectrum H-68-1840-6
Synonyms (1-acetyl-5-methyl-1H-indol-2-yl)methyl methyl sulfone 1-Acetyl-5-methyl-2-(methylsulfonyl)methylindol 1-Acetyl-5-methyl-2-[(methylsulfonyl)methyl]-1H-indole
Wiley ID 1268826