| SpectraBase Spectrum ID |
6JyW6WFdIX0 |
| Name |
Thujene |
| CAS Registry Number |
2867-05-2 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
136.125200515 u |
| Formula |
C10H16 |
| InChI |
InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3 |
| InChIKey |
KQAZVFVOEIRWHN-UHFFFAOYSA-N |
| Molecular Weight |
136.238 g/mol |
| Number of Peaks |
50 |
| RI1 |
927 |
| RI2 |
605 |
| SMILES |
C12C(=CCC2(C1)C(C)C)C |
| SPLASH |
splash10-0006-9000000000-29f81079f9d2b1001123 |
| 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 |
Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)- |
| Wiley ID |
LM_FFNSC3_957 |
