| SpectraBase Spectrum ID |
DB3u2ysSvbx |
| Name |
Isobornyl isobutyrate |
| CAS Registry Number |
85586-67-0 |
| 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 |
224.177630011 u |
| Formula |
C14H24O2 |
| InChI |
InChI=1S/C14H24O2/c1-9(2)12(15)16-11-8-10-6-7-14(11,5)13(10,3)4/h9-11H,6-8H2,1-5H3/t10-,11-,14+/m1/s1 |
| InChIKey |
KRKIAJBQOUBNSE-GYSYKLTISA-N |
| Molecular Weight |
224.344 g/mol |
| Number of Peaks |
50 |
| RI1 |
1431 |
| RI2 |
1110 |
| SMILES |
[C@@]1(C[C@]2(CC[C@@]1(C2(C)C)C)[H])(OC(=O)C(C)C)[H] |
| SPLASH |
splash10-006x-9400000000-93c03283ae0e778be3dc |
| 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 |
Propanoic acid, 2-methyl-, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester |
| Wiley ID |
LM_FFNSC3_1671 |
