SpectraBase Spectrum ID |
1q56SdhS4gF |
Name |
3-Methylapopinene |
CAS Registry Number |
4889-83-2 |
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 |
136.125200515 u |
Formula |
C10H16 |
InChI |
InChI=1S/C10H16/c1-7-4-8-6-9(5-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 |
InChIKey |
ZJUDTXCEVUJEOX-UHFFFAOYSA-N |
Molecular Weight |
136.238 g/mol |
Number of Peaks |
50 |
RI1 |
927 |
RI2 |
605 |
RI3 |
490 |
RI4 |
445 |
RI5 |
942 |
SMILES |
CC1=CC2C(C(C1)C2)(C)C |
SPLASH |
splash10-0006-9100000000-f9e960b29a360dbd49c6 |
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[3.1.1]hept-2-ene, 3,6,6-trimethyl |
Wiley ID |
LM_FFNSC3_3281 |