| SpectraBase Spectrum ID |
KZwkkUAMQd0 |
| Name |
methyl (S,Z)-12-(2-ethoxy-4-formylphenoxy)octadec-9-enoate |
| Appearance |
Colorless liquid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.318874512 u |
| Formula |
C28H44O5 |
| GC Oven Program |
Oven temp 250oC |
| InChI |
InChI=1S/C28H44O5/c1-4-6-7-14-17-25(33-26-21-20-24(23-29)22-27(26)32-5-2)18-15-12-10-8-9-11-13-16-19-28(30)31-3/h12,15,20-23,25H,4-11,13-14,16-19H2,1-3H3/b15-12-/t25-/m0/s1 |
| InChIKey |
LYJHBKLSXGTFOJ-WCKUGHEZSA-N |
| Inlet Type |
Splitless |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
460.655 g/mol |
| Quality |
91 |
| SMILES |
COC(CCCCCCC\C=C/C[C@](CCCCCC)(OC1=C(C=C(C=C1)C=O)OCC)[H])=O |
| SPLASH |
splash10-014i-2920000000-64adc2a7b11a453ab46a |
| Source of Spectrum |
WO2023067040A1 |
| Wiley ID |
1897168 |
