| SpectraBase Spectrum ID |
5QsBXXb94f8 |
| Name |
Methyl communate <(E)-> |
| CAS Registry Number |
15798-13-7 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
316.240230268 u |
| Formula |
C21H32O2 |
| InChI |
InChI=1S/C21H32O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9+ |
| InChIKey |
WYJKGKPQXWDIQP-OQLLNIDSSA-N |
| Molecular Weight |
316.485 g/mol |
| Number of Peaks |
50 |
| RI1 |
2258 |
| SMILES |
COC(=O)C1(C)CCCC2(C)C(C\C=C/(C)C=C)C(=C)CCC12 |
| SPLASH |
splash10-054o-9700000000-04762815ed74851393cc |
| 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 |
1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-methylene-5-[(2E)-3-methyl-2,4-pentadien-1-yl]-, methyl ester |
| Wiley ID |
LM_FFNSC3_2309 |
