For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-Dodecyne

View entire compound with spectra: 2 NMR, and 4 MS (GC)

3-Dodecyne
SpectraBase Compound ID DpjXuUQcNq
InChI InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3-5,7,9-12H2,1-2H3
InChIKey ZFAGQZXKTQFQLE-UHFFFAOYSA-N
Mol Weight 166.31 g/mol
Molecular Formula C12H22
Exact Mass 166.172151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Cvce9k9aLBk
Name 3-Dodecyne
CAS Registry Number 6790-27-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22
InChI InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3-5,7,9-12H2,1-2H3
InChIKey ZFAGQZXKTQFQLE-UHFFFAOYSA-N
Instrument Name Special
Literature Reference D.E. Dorman, M. Jautelat, J.D. Roberts, J. Org. Chem. 38, 1027 (1973).
NMR Standard CS2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid