| SpectraBase Spectrum ID |
FfYSwqxDz2x |
| Name |
Dulcinyl |
| CAS Registry Number |
55418-52-5 |
| 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 |
192.078644243 u |
| Formula |
C11H12O3 |
| InChI |
InChI=1S/C11H12O3/c1-8(12)2-3-9-4-5-10-11(6-9)14-7-13-10/h4-6H,2-3,7H2,1H3 |
| InChIKey |
TZJLGGWGVLADDN-UHFFFAOYSA-N |
| Molecular Weight |
192.214 g/mol |
| Number of Peaks |
50 |
| RI1 |
1602 |
| RI2 |
1280 |
| RI3 |
1896 |
| RI4 |
1861 |
| RI5 |
1489 |
| SMILES |
CC(CCc1cc2c(cc1)OCO2)=O |
| SPLASH |
splash10-000f-7900000000-8152eb60f2f91a8e51d3 |
| 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 |
2-Butanone, 4-(1,3-benzodioxol-5-yl)- |
| Wiley ID |
LM_FFNSC3_580 |
