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3-Chloro-1-methyl-1H-indole
SpectraBase Compound ID 8r4QBH4QmW7
InChI InChI=1S/C9H8ClN/c1-11-6-8(10)7-4-2-3-5-9(7)11/h2-6H,1H3
InChIKey NTDMKGOOZUQYDH-UHFFFAOYSA-N
Mol Weight 165.62 g/mol
Molecular Formula C9H8ClN
Exact Mass 165.034527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMhakuLQkwA
Name 3-Chloro-1-methyl-1H-indole
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClN
InChI InChI=1S/C9H8ClN/c1-11-6-8(10)7-4-2-3-5-9(7)11/h2-6H,1H3
InChIKey NTDMKGOOZUQYDH-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901492
Molecular Weight 165.623 g/mol
SMILES c1ccc2c(c1)c(c[n]2C)Cl
SPLASH splash10-014i-1900000000-4702939d47059fd0674d
Source of Spectrum ASC-362-SM29-3a
Thin-Layer Chromatography Rf = 0.43 (EtOAc/PE, 1:30)
Wiley ID 1839400