| SpectraBase Spectrum ID |
agP9Yhv8xA |
| Name |
Anisylacetone |
| Source of Sample |
SAFC Cat.no. W267201 |
| CAS Registry Number |
104-20-1 |
| 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 |
178.099379689 u |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3 |
| InChIKey |
PCBSXBYCASFXTM-UHFFFAOYSA-N |
| Molecular Weight |
178.231 g/mol |
| Number of Peaks |
50 |
| RI1 |
1501 |
| RI2 |
1178 |
| RI3 |
1656 |
| RI4 |
1616 |
| SMILES |
CC(CCc1ccc(cc1)OC)=O |
| SPLASH |
splash10-00di-4900000000-a0987d72a00c8ad5db04 |
| 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-(4-methoxyphenyl)- |
| Wiley ID |
LM_FFNSC3_546 |
