| SpectraBase Spectrum ID |
7FXmJqYfoB8 |
| Name |
Italicene |
| CAS Registry Number |
94450-85-8 |
| 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/c1-10-7-8-15-11(2)5-6-12(15)14(3,4)13(15)9-10/h9,11-13H,5-8H2,1-4H3/t11-,12+,13+,15+/m0/s1 |
| InChIKey |
BWAXOYJGXIEEOE-KYEXWDHISA-N |
| Molecular Weight |
204.357 g/mol |
| Number of Peaks |
50 |
| RI1 |
1410 |
| RI2 |
1089 |
| SMILES |
C1C(=C[C@]2([C@@]3(C1)[C@](C2(C)C)([H])CC[C@@]3(C)[H])[H])C |
| SPLASH |
splash10-014l-7900000000-a8e7c3d1b8901531a121 |
| 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 |
Cyclopenta[1,4]cyclobuta[1,2]benzene,1,2,3,3a,4,4a,7,8-octahydro-1,4,4,6-tetramethyl-,(1alpha,3aalpha,4abeta,8aS*) |
| Wiley ID |
LM_FFNSC3_1204 |
