| SpectraBase Spectrum ID |
vnMbVtN6dN |
| Name |
Anisic acid ester |
| Source of Sample |
SAFC Cat.no. W242004 |
| CAS Registry Number |
94-30-4 |
| 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 |
180.078644243 u |
| Formula |
C10H12O3 |
| InChI |
InChI=1S/C10H12O3/c1-3-13-10(11)8-4-6-9(12-2)7-5-8/h4-7H,3H2,1-2H3 |
| InChIKey |
FHUODBDRWMIBQP-UHFFFAOYSA-N |
| Molecular Weight |
180.203 g/mol |
| Number of Peaks |
50 |
| RI1 |
1454 |
| RI2 |
1132 |
| RI3 |
1437 |
| RI4 |
1396 |
| RI5 |
1422 |
| SMILES |
c1c(ccc(c1)C(OCC)=O)OC |
| SPLASH |
splash10-000i-4900000000-c416a9b58b61c7055bba |
| 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-, ethyl ester |
| Wiley ID |
LM_FFNSC3_80 |
