| SpectraBase Spectrum ID |
7QRT40899sD |
| Name |
Laurenene |
| CAS Registry Number |
110455-92-0 |
| 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 |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-14-7-6-10-18(4)12-9-16-17(2,3)13-19(5)11-8-15(14)20(16,18)19/h8,14,16H,6-7,9-13H2,1-5H3/t14-,16-,18+,19-,20?/m0/s1 |
| InChIKey |
TYDFDHZTDWVUJF-UJSRRMEDSA-N |
| Molecular Weight |
272.476 g/mol |
| Number of Peaks |
50 |
| RI1 |
1903 |
| SMILES |
[C@@]12(CC=C3[C@](CCC[C@]4(C23[C@@](CC4)(C(C)(C1)C)[H])C)(C)[H])C |
| SPLASH |
splash10-0a4i-5940000000-58fd0d5455884b1ea49e |
| 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 |
Pentaleno(1,6-cd)azulene,1,2,2a,3,4,4a,5,7,8,9,10,10a-dodecahydro-3,3,4a,7,10a-pentamethyl- |
| Wiley ID |
LM_FFNSC3_2114 |
