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1-Allyl-3-methyl-1H-indole
SpectraBase Compound ID EjdcDnCNxRt
InChI InChI=1S/C12H13N/c1-3-8-13-9-10(2)11-6-4-5-7-12(11)13/h3-7,9H,1,8H2,2H3
InChIKey BVJZDDBRQFJGQR-UHFFFAOYSA-N
Mol Weight 171.24 g/mol
Molecular Formula C12H13N
Exact Mass 171.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KDpCxllDpl
Name 1-Allyl-3-methyl-1H-indole
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 171.104799423 u
Formula C12H13N
InChI InChI=1S/C12H13N/c1-3-8-13-9-10(2)11-6-4-5-7-12(11)13/h3-7,9H,1,8H2,2H3
InChIKey BVJZDDBRQFJGQR-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202200676
Molecular Weight 171.243 g/mol
Quality 20
Reported Formula C12H13N
SMILES C1=CC2=C(C=C1)N(C=C2C)CC=C
SPLASH splash10-05gi-0900000000-38c62a1a3db26c4c9226
Source of Spectrum AJO-12-SM3-2b (DOI: 10.1002/ajoc.202200676)
Wiley ID 1900884