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1-(1-besylindol-2-yl)-3-chloro-3-methyl-butan-1-one
SpectraBase Compound ID CTBBzjhuYNh
InChI InChI=1S/C19H18ClNO3S/c1-19(2,20)13-18(22)17-12-14-8-6-7-11-16(14)21(17)25(23,24)15-9-4-3-5-10-15/h3-12H,13H2,1-2H3
InChIKey FMGKMCJTIYAZJF-UHFFFAOYSA-N
Mol Weight 375.87 g/mol
Molecular Formula C19H18ClNO3S
Exact Mass 375.069592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9mpA9eV3u0v
Name 1-(1-besylindol-2-yl)-3-chloro-3-methyl-butan-1-one
Alternate Name(s) 1-[1-(benzenesulfonyl)-2-indolyl]-3-chloro-3-methyl-1-butanone 1-[1-(benzenesulfonyl)indol-2-yl]-3-chloro-3-methyl-butan-1-one 3-Chloranyl-3-methyl-1-[1-(phenylsulfonyl)indol-2-yl]butan-1-one
CAS Registry Number 102210-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClNO3S
InChI InChI=1S/C19H18ClNO3S/c1-19(2,20)13-18(22)17-12-14-8-6-7-11-16(14)21(17)25(23,24)15-9-4-3-5-10-15/h3-12H,13H2,1-2H3
InChIKey FMGKMCJTIYAZJF-UHFFFAOYSA-N
Molecular Weight 375.870 g/mol
SMILES c1(S([n]2c(cc3c2cccc3)C(CC(Cl)(C)C)=O)(=O)=O)ccccc1
SPLASH splash10-003s-0932000000-9386c20a8f8bf0f9cf9d
Source of Spectrum J-51-2350-18
Wiley ID 1357140