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1-(1H-indol-3-yl)-3-methyl-1-butanone
SpectraBase Compound ID DTdUHU7llZl
InChI InChI=1S/C13H15NO/c1-9(2)7-13(15)11-8-14-12-6-4-3-5-10(11)12/h3-6,8-9,14H,7H2,1-2H3
InChIKey RQDSUVCWFCIDAP-UHFFFAOYSA-N
Mol Weight 201.27 g/mol
Molecular Formula C13H15NO
Exact Mass 201.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDZUnMO7xtI
Name 1-(1H-indol-3-yl)-3-methyl-1-butanone
Alternate Name(s) 1-(1H-indol-3-yl)-3-methyl-butan-1-one
CAS Registry Number 69622-34-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO
InChI InChI=1S/C13H15NO/c1-9(2)7-13(15)11-8-14-12-6-4-3-5-10(11)12/h3-6,8-9,14H,7H2,1-2H3
InChIKey RQDSUVCWFCIDAP-UHFFFAOYSA-N
Molecular Weight 201.269 g/mol
SMILES [nH]1c2c(c(c1)C(CC(C)C)=O)cccc2
SPLASH splash10-0006-1910000000-ad800ea4d6d905bdf76a
Source of Spectrum J-51-2349-12
Wiley ID 1198959