SpectraBase Spectrum ID |
C6ivRLJCCUt |
Name |
Pinocarvyl acetate |
CAS Registry Number |
1686-15-3 |
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 |
194.130679818 u |
Formula |
C12H18O2 |
InChI |
InChI=1S/C12H18O2/c1-7-10-5-9(12(10,3)4)6-11(7)14-8(2)13/h9-11H,1,5-6H2,2-4H3/t9-,10+,11+/m1/s1 |
InChIKey |
UDBAGFUFASPUFS-VWYCJHECSA-N |
Molecular Weight |
194.274 g/mol |
Number of Peaks |
50 |
RI1 |
1296 |
RI2 |
974 |
SMILES |
C1([C@]2(C[C@@](C([C@@]1(C2)[H])=C)(OC(C)=O)[H])[H])(C)C |
SPLASH |
splash10-0006-9200000000-481f1b15cecb93a6851b |
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]heptan-3-ol, 6,6-dimethyl-2-methylene-, acetate, (1R,3S,5R)- |
Wiley ID |
LM_FFNSC3_1693 |