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1-Butyl-1-aza-3,11-cyclotridecadiyne
SpectraBase Compound ID DaAUPuG89Yr
InChI InChI=1S/C16H25N/c1-2-3-14-17-15-12-10-8-6-4-5-7-9-11-13-16-17/h2-9,14-16H2,1H3
InChIKey IZWGEKAUGBEKHE-UHFFFAOYSA-N
Mol Weight 231.38 g/mol
Molecular Formula C16H25N
Exact Mass 231.1987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pztDHSPMcj
Name 1-Butyl-1-aza-3,11-cyclotridecadiyne
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25N
InChI InChI=1S/C16H25N/c1-2-3-14-17-15-12-10-8-6-4-5-7-9-11-13-16-17/h2-9,14-16H2,1H3
InChIKey IZWGEKAUGBEKHE-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 231.383 g/mol
SMILES C1#CCCCCCCC#CCN(CCCC)C1
SPLASH splash10-000i-2900000000-8cabe948a954344eccd9
Source of Spectrum RU2632674C2
Thin-Layer Chromatography Rf = 0.47 (hexane/EtOAc, 1:1)
Wiley ID 1866045