| SpectraBase Spectrum ID |
7KFRxHkCIze |
| Name |
Nerate |
| CAS Registry Number |
1862-61-9 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
182.130679818 u |
| Formula |
C11H18O2 |
| InChI |
InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8- |
| InChIKey |
ACOBBFVLNKYODD-NTMALXAHSA-N |
| Molecular Weight |
182.263 g/mol |
| Number of Peaks |
50 |
| RI1 |
1276 |
| RI2 |
954 |
| SMILES |
C(OC)(\C=C/(CCC=C(C)C)C)=O |
| SPLASH |
splash10-014l-9300000000-6f0b92370d73e05b5920 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (2Z)- |
| Wiley ID |
LM_FFNSC3_1403 |
