SpectraBase Spectrum ID |
wDaYMNrWDl |
Name |
methyl (E)-undec-4-enoate |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
198.161979946 u |
Formula |
C12H22O2 |
GC Column |
HP-1 (50 m x 0.2 mm, film thickness 0.33 micrometer) |
GC Oven Program |
Oven temp 250oC |
InChI |
InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h8-9H,3-7,10-11H2,1-2H3/b9-8+ |
InChIKey |
JNHQWMNCUGJVSI-CMDGGOBGSA-N |
Inlet Type |
Split (1:100) |
Instrument Name |
Agilent 6890N-Agilent 5973N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/cbdv.202200817 |
Molecular Weight |
198.306 g/mol |
Quality |
938 |
SMILES |
C(\C=C\CCC(=O)OC)CCCCC |
SPLASH |
splash10-00e9-9400000000-5e8e2e9b8f4832b10fc0 |
Source of Spectrum |
CBD-20-SM51-5e (DOI: 10.1002/cbdv.202200817) |
Wiley ID |
1901380 |