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2-[2-(2-methylallyl)cyclobuten-1-yl]quinoline
SpectraBase Compound ID LaoTixnkm4N
InChI InChI=1S/C17H17N/c1-12(2)11-14-7-9-15(14)17-10-8-13-5-3-4-6-16(13)18-17/h3-6,8,10H,1,7,9,11H2,2H3
InChIKey LJGWZDLWRCLRFM-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C17H17N
Exact Mass 235.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HWiXqthIov
Name 2-[2-(2-methylallyl)cyclobuten-1-yl]quinoline
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.136099551 u
Formula C17H17N
InChI InChI=1S/C17H17N/c1-12(2)11-14-7-9-15(14)17-10-8-13-5-3-4-6-16(13)18-17/h3-6,8,10H,1,7,9,11H2,2H3
InChIKey LJGWZDLWRCLRFM-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201604585
Molecular Weight 235.330 g/mol
Quality 57
Reported Formula C17H17N
SMILES C=C(C)CC1=C(CC1)C1=NC2=C(C=C1)C=CC=C2
SPLASH splash10-0fl3-0490000000-bd09c7b40b2364aa0aee
Source of Spectrum QE-23-SM39-21e (DOI: 10.1002/chem.201604585)
Thin-Layer Chromatography 0.5 (hexane/EtOAc, 9:1, UV, KMnO4, PAA)
Wiley ID 1903893