| SpectraBase Spectrum ID |
8wvQAYJO7g2 |
| Name |
Cymen-7-yl tiglate, para |
| CAS Registry Number |
1231958-86-3 |
| 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 |
232.146329882 u |
| Formula |
C15H20O2 |
| InChI |
InChI=1S/C15H20O2/c1-5-12(4)15(16)17-10-13-6-8-14(9-7-13)11(2)3/h5-9,11H,10H2,1-4H3/b12-5+ |
| InChIKey |
LSBJXCPAODEBCB-LFYBBSHMSA-N |
| Molecular Weight |
232.323 g/mol |
| Number of Peaks |
50 |
| RI1 |
1760 |
| RI2 |
1437 |
| RI3 |
1737 |
| RI4 |
1701 |
| RI5 |
1726 |
| SMILES |
C\C(C(=O)OCc1ccc(cc1)C(C)C)=C/C |
| SPLASH |
splash10-05o0-8900000000-95492daa4acd8284851f |
| 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-Butenoic acid, 2-methyl-, [4-(1-methylethyl)phenyl]methyl ester, (2E)- |
| Wiley ID |
LM_FFNSC3_3410 |
