| SpectraBase Spectrum ID |
4Adu00PdkmQ |
| Name |
Nopyl tiglate |
| CAS Registry Number |
1231959-75-3 |
| 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 |
248.177630011 u |
| Formula |
C16H24O2 |
| InChI |
InChI=1S/C16H24O2/c1-5-11(2)15(17)18-9-8-12-6-7-13-10-14(12)16(13,3)4/h5-6,13-14H,7-10H2,1-4H3/b11-5+ |
| InChIKey |
DDJDDUGFXWVIGI-VZUCSPMQSA-N |
| Molecular Weight |
248.366 g/mol |
| Number of Peaks |
50 |
| RI1 |
1754 |
| RI2 |
1429 |
| RI3 |
1540 |
| RI4 |
1502 |
| RI5 |
1735 |
| SMILES |
C\C(C(=O)OCCC=1C2C(C(CC1)C2)(C)C)=C/C |
| SPLASH |
splash10-0a4i-6900000000-e9e7e28c16138b1bcf68 |
| 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-, 2-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)ethyl ester, (2E)- |
| Wiley ID |
LM_FFNSC3_3434 |
