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Propyl 1,2-dimethyl-1H-indole-3-sulfonate
SpectraBase Compound ID 8xituYiMcaY
InChI InChI=1S/C13H17NO3S/c1-4-9-17-18(15,16)13-10(2)14(3)12-8-6-5-7-11(12)13/h5-8H,4,9H2,1-3H3
InChIKey RAOINMSXPUVYLS-UHFFFAOYSA-N
Mol Weight 267.34 g/mol
Molecular Formula C13H17NO3S
Exact Mass 267.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7dUeJs3UO
Name Propyl 1,2-dimethyl-1H-indole-3-sulfonate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.092914582 u
Formula C13H17NO3S
InChI InChI=1S/C13H17NO3S/c1-4-9-17-18(15,16)13-10(2)14(3)12-8-6-5-7-11(12)13/h5-8H,4,9H2,1-3H3
InChIKey RAOINMSXPUVYLS-UHFFFAOYSA-N
Instrument Name Agilent 5975N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201612565
Molecular Weight 267.343 g/mol
Quality 157
Reported Formula C13H17NO3S
SMILES C1(S(OCCC)(=O)=O)=C(N(C2=C1C=CC=C2)C)C
SPLASH splash10-0a4i-9250000000-82278024e0b5e2a429a5
Source of Spectrum ACI-56-SM30-3j (DOI: 10.1002/anie.201612565)
Wiley ID 1895548