| SpectraBase Spectrum ID |
Ejn0kFwQhhV |
| Name |
Isobornyl isobutanoate <5-oxy-> |
| CAS Registry Number |
107783-31-3 |
| 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 |
238.156894565 u |
| Formula |
C14H22O3 |
| InChI |
InChI=1S/C14H22O3/c1-8(2)12(16)17-11-6-9-10(15)7-14(11,5)13(9,3)4/h8-9,11H,6-7H2,1-5H3/t9-,11+,14-/m0/s1 |
| InChIKey |
OHPJGLFLDMKGHR-PXWWUCIGSA-N |
| Molecular Weight |
238.327 g/mol |
| Number of Peaks |
50 |
| RI1 |
1601 |
| SMILES |
C[C@@]12CC([C@](C[C@]2(OC(C(C)C)=O)[H])(C1(C)C)[H])=O |
| SPLASH |
splash10-0596-9400000000-f37958fb97525627ef67 |
| 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-trimethyl-5-oxobicyclo[2.2.1]hept-2-yl ester |
| Wiley ID |
LM_FFNSC3_2138 |
