| SpectraBase Spectrum ID |
JzaOEesFFGx |
| Name |
Clarycet, anti- |
| CAS Registry Number |
131766-73-9 |
| 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 |
200.141244501 u |
| Formula |
C11H20O3 |
| InChI |
InChI=1S/C11H20O3/c1-4-5-10-8-11(3,6-7-13-10)14-9(2)12/h10H,4-8H2,1-3H3 |
| InChIKey |
GURYYNWDVKXZAT-UHFFFAOYSA-N |
| Molecular Weight |
200.278 g/mol |
| Number of Peaks |
50 |
| RI1 |
1272 |
| RI2 |
949 |
| RI3 |
1009 |
| RI4 |
965 |
| RI5 |
1256 |
| SMILES |
C(C)(=O)OC1(CC(OCC1)CCC)C |
| SPLASH |
splash10-0005-9100000000-c4c646197aebf444d74e |
| 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 |
2H-Pyran-4-ol, tetrahydro-4-methyl-2-propyl-, 4-acetate |
| Wiley ID |
LM_FFNSC3_3208 |
