| SpectraBase Spectrum ID |
3sd7PGp8GDG |
| Name |
Rotundene |
| CAS Registry Number |
65128-08-7 |
| 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 |
204.187800773 u |
| Formula |
C15H24 |
| InChI |
InChI=1S/C15H24/c1-10-4-5-14-13(10)8-12-6-7-15(14,3)9-11(12)2/h9-10,12-14H,4-8H2,1-3H3/t10?,12-,13?,14?,15-/m1/s1 |
| InChIKey |
XAAMMPKFMNZIIC-WDJGLXJESA-N |
| Molecular Weight |
204.357 g/mol |
| Number of Peaks |
50 |
| RI1 |
1456 |
| SMILES |
C1C(C2C[C@]3(CC[C@](C2C1)(C)C=C3C)[H])C |
| SPLASH |
splash10-0a4l-7900000000-efb2c009953432e3f294 |
| 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 |
4,7-Ethanoazulene, 1,2,3,3a,4,7,8,8a-octahydro-1,4,6-trimethyl- |
| Wiley ID |
LM_FFNSC3_2450 |
