| SpectraBase Spectrum ID |
I045hs3ECWp |
| Name |
Barbatene |
| CAS Registry Number |
72346-55-5 |
| 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 |
204.187800773 u |
| Formula |
C15H24 |
| InChI |
InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14+,15-/m0/s1 |
| InChIKey |
RTONMYLSQISFQA-XQLPTFJDSA-N |
| Molecular Weight |
204.357 g/mol |
| Number of Peaks |
50 |
| RI1 |
1445 |
| SMILES |
[C@]12([C@]([C@]3(CCC([C@@]2(C3)[H])=C)C)(CCC1)C)C |
| SPLASH |
splash10-052g-9300000000-60cc072e3119721dc9c7 |
| 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 |
4,8-Methanoazulene, decahydro-3a,4,8a-trimethyl-7-methylene- |
| Wiley ID |
LM_FFNSC3_2504 |
