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1H-Indole, 3-(1-oxobutyl)-1-(phenylsulfonyl)-
SpectraBase Compound ID D401mmLdrcA
InChI InChI=1S/C18H17NO3S/c1-2-8-18(20)16-13-19(17-12-7-6-11-15(16)17)23(21,22)14-9-4-3-5-10-14/h3-7,9-13H,2,8H2,1H3
InChIKey SJHZXQIVIQWJTN-UHFFFAOYSA-N
Mol Weight 327.4 g/mol
Molecular Formula C18H17NO3S
Exact Mass 327.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HPc64SR1OpN
Name 1H-Indole, 3-(1-oxobutyl)-1-(phenylsulfonyl)-
Alternate Name(s) 1-(Phenylsulfonyl)-3-butyrylindole 1-[1-(phenylsulfonyl)-1H-indol-3-yl]-1-butanone
CAS Registry Number 114906-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO3S
InChI InChI=1S/C18H17NO3S/c1-2-8-18(20)16-13-19(17-12-7-6-11-15(16)17)23(21,22)14-9-4-3-5-10-14/h3-7,9-13H,2,8H2,1H3
InChIKey SJHZXQIVIQWJTN-UHFFFAOYSA-N
Molecular Weight 327.398 g/mol
SMILES c1(S([n]2cc(C(=O)CCC)c3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-004u-8972000000-9db9fd44997ff95f15d3
Source of Spectrum J-53-3175-15
Wiley ID 1325498