| SpectraBase Spectrum ID |
CUjH4sD9J4Z |
| Name |
Pinocamphyl tiglate, iso- |
| CAS Registry Number |
1231959-98-0 |
| 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 |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-6-9(2)14(16)17-13-8-11-7-12(10(13)3)15(11,4)5/h6,10-13H,7-8H2,1-5H3/b9-6+/t10-,11+,12-,13-/m1/s1 |
| InChIKey |
OBQIIIOSVMYJCA-YUNYCBJESA-N |
| Molecular Weight |
236.355 g/mol |
| Number of Peaks |
50 |
| RI1 |
1630 |
| RI2 |
1306 |
| RI3 |
1369 |
| RI4 |
1330 |
| RI5 |
1611 |
| SMILES |
C\C(C(=O)O[C@]1([C@@]([C@@]2(C([C@](C1)(C2)[H])(C)C)[H])(C)[H])[H])=C/C |
| SPLASH |
splash10-001l-9000000000-59ba7c2a0d9bcd8d1174 |
| 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-, (1R,2R,3R,5S)-2,6,6-trimethylbicyclo[3.1.1]hept-3-yl ester, (2E)-rel- |
| Wiley ID |
LM_FFNSC3_3430 |
