| SpectraBase Spectrum ID |
33Uq302flol |
| Name |
Rosephenone |
| CAS Registry Number |
90-17-5 |
| 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 |
265.966812628 u |
| Formula |
C10H9Cl3O2 |
| InChI |
InChI=1S/C10H9Cl3O2/c1-7(14)15-9(10(11,12)13)8-5-3-2-4-6-8/h2-6,9H,1H3 |
| InChIKey |
JKRWZLOCPLZZEI-UHFFFAOYSA-N |
| Molecular Weight |
267.539 g/mol |
| Number of Peaks |
50 |
| RI1 |
1554 |
| RI2 |
1232 |
| RI3 |
1575 |
| RI4 |
1537 |
| RI5 |
1534 |
| SMILES |
C(C)(=O)OC(C(Cl)(Cl)Cl)c1ccccc1 |
| SPLASH |
splash10-0a4l-7900000000-af8057ba5ae67f778c44 |
| 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 |
Benzenemethanol, -(trichloromethyl)-, 1-acetate |
| Wiley ID |
LM_FFNSC3_3163 |
