| SpectraBase Spectrum ID |
iHihm0T41a |
| Name |
Anisate |
| Source of Sample |
SAFC Cat.no. W267902 |
| CAS Registry Number |
121-98-2 |
| 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 |
166.062994179 u |
| Formula |
C9H10O3 |
| InChI |
InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3 |
| InChIKey |
DDIZAANNODHTRB-UHFFFAOYSA-N |
| Molecular Weight |
166.176 g/mol |
| Number of Peaks |
50 |
| RI1 |
1375 |
| RI2 |
1053 |
| SMILES |
c1c(ccc(c1)C(OC)=O)OC |
| SPLASH |
splash10-000i-5900000000-33723eab5177b4edb78b |
| 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 |
Benzoic acid, 4-methoxy-, methyl ester |
| Wiley ID |
LM_FFNSC3_552 |
