| SpectraBase Spectrum ID |
3LCzQancJM |
| Name |
(11-13C,1,1-2H2)-(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-ol |
| Appearance |
Colourless liquid |
| Carrier Gas |
Helium (1 mL/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14[13C]H24D2O |
| GC Column |
HP5-MS (30 m x 0.25 mm, film thickness 0.50 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9+,15-11+/i12D2,13+1 |
| InChIKey |
CRDAMVZIKSXKFV-ARPVSFJGSA-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 |
225.377 g/mol |
| Quality |
311 |
| SMILES |
OC(\C=C\(CC\C=C\(CCC=[13C](C)C)C)C)([D])[D] |
| SPLASH |
splash10-00dl-9100000000-dea83283054b7b425ed0 |
| Sample Comments |
(2E)-isomer |
| Source of Spectrum |
ACI-55-SM21-(11-13C,1,1-2H2)-30 (DOI: 10.1002/anie.201608042) |
| Thin-Layer Chromatography |
0.44 (cyclohexane/EtOAc, 3:1) |
| Wiley ID |
1908169 |
