| SpectraBase Spectrum ID |
IyElnkqfIwA |
| Name |
Ethyl (11-13C)-(2Z,6E)-3,7,11-trimethyldodeca-2,6,10-trienoate |
| Carrier Gas |
Helium (1 mL/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.212284975 u |
| Formula |
C16[13C]H28O2 |
| GC Column |
HP5-MS (30 m x 0.25 mm, film thickness 0.50 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C17H28O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,13H,6-8,10,12H2,1-5H3/b15-11+,16-13-/i14+1 |
| InChIKey |
RAVLTUCAFRTDRY-TVZQVMENSA-N |
| Inlet Type |
Split (10:1) |
| Instrument Name |
Agilent 7890B-Agilent 5977A inert MSD |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201608042 |
| Molecular Weight |
265.401 g/mol |
| Quality |
417 |
| SMILES |
C(CC=[13C](C)C)\C(C)=C\CC\C(C)=C/C(OCC)=O |
| SPLASH |
splash10-00di-9600000000-76ebfc69c9a8e5138efd |
| Sample Comments |
(2Z)-isomer |
| Source of Spectrum |
ACI-55-SM20-(11-13C)-28 (DOI: 10.1002/anie.201608042) |
| Thin-Layer Chromatography |
0.59 (cyclohexane/EtOAc, 10:1) |
| Wiley ID |
1908166 |
