| SpectraBase Spectrum ID |
85fxxhyW1mU |
| Name |
Exalatacin |
| CAS Registry Number |
23724-20-1 |
| 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 |
222.089208927 u |
| Formula |
C12H14O4 |
| InChI |
InChI=1S/C12H14O4/c1-4-5-8-9(13-2)6-10-12(11(8)14-3)16-7-15-10/h4,6H,1,5,7H2,2-3H3 |
| InChIKey |
DLXIQKGNIITZEK-UHFFFAOYSA-N |
| Molecular Weight |
222.240 g/mol |
| Number of Peaks |
50 |
| RI1 |
1656 |
| SMILES |
C1Oc2c(O1)c(c(c(c2)OC)CC=C)OC |
| SPLASH |
splash10-0fmi-9730000000-422ed502cd4e94fbcc63 |
| 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 |
Phenol, 2-(1E)-1-propen-1-yl- |
| Wiley ID |
LM_FFNSC3_2747 |
