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5-Bromo-1-methyl-3-propyl-1H-indole
SpectraBase Compound ID LIL25lJLLNu
InChI InChI=1S/C12H14BrN/c1-3-4-9-8-14(2)12-6-5-10(13)7-11(9)12/h5-8H,3-4H2,1-2H3
InChIKey DLQDSORDAMBXNG-UHFFFAOYSA-N
Mol Weight 252.15 g/mol
Molecular Formula C12H14BrN
Exact Mass 251.030962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbCoHEkndDJ
Name 5-Bromo-1-methyl-3-propyl-1H-indole
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.030962455 u
Formula C12H14BrN
InChI InChI=1S/C12H14BrN/c1-3-4-9-8-14(2)12-6-5-10(13)7-11(9)12/h5-8H,3-4H2,1-2H3
InChIKey DLQDSORDAMBXNG-UHFFFAOYSA-N
Instrument Name JEOL JMS 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702338
Molecular Weight 252.155 g/mol
Quality 78
Reported Formula C12H14NBr
SMILES C1(Br)=CC2=C(C=C1)N(C=C2CCC)C
SPLASH splash10-00di-0090000000-5834d410b3b823df6155
Source of Spectrum QE-23-SM3-6d (DOI: 10.1002/chem.201702338)
Wiley ID 1905681