| SpectraBase Spectrum ID |
9fxUtYbvekx |
| Name |
Isobornyl acetate |
| Source of Sample |
SAFC Cat.no. W216003 |
| CAS Registry Number |
125-12-2 |
| 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 |
196.146329882 u |
| Formula |
C12H20O2 |
| InChI |
InChI=1S/C12H20O2/c1-8(13)14-10-7-9-5-6-12(10,4)11(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10-,12+/m1/s1 |
| InChIKey |
KGEKLUUHTZCSIP-FOGDFJRCSA-N |
| Molecular Weight |
196.290 g/mol |
| Number of Peaks |
50 |
| RI1 |
1287 |
| RI2 |
965 |
| RI3 |
989 |
| RI4 |
947 |
| RI5 |
1272 |
| SMILES |
[C@@]1(C[C@]2(CC[C@@]1(C2(C)C)C)[H])(OC(C)=O)[H] |
| SPLASH |
splash10-0007-9400000000-2d3b005946ae2a343514 |
| 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[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1R,2R,4R)- |
| Wiley ID |
LM_FFNSC3_1629 |
