SpectraBase Spectrum ID |
ERjBwEQma3a |
Name |
Calarene |
CAS Registry Number |
79433-67-3 |
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/c1-10-6-5-7-11-8-9-12-13(14(12,2)3)15(10,11)4/h7,10,12-13H,5-6,8-9H2,1-4H3 |
InChIKey |
MBIPADCEHSKJDQ-UHFFFAOYSA-N |
Molecular Weight |
204.357 g/mol |
Number of Peaks |
50 |
RI1 |
1434 |
RI2 |
1113 |
SMILES |
C1CC=C2C(C1C)(C1C(CC2)C1(C)C)C |
SPLASH |
splash10-03dl-5900000000-d8eb17cac4cbb7805ed1 |
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 |
1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl- |
Wiley ID |
LM_FFNSC3_1464 |