| SpectraBase Spectrum ID |
GBMRRDYZF97 |
| Name |
Anisyl acetate |
| CAS Registry Number |
1331-83-5 |
| 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 |
180.078644243 u |
| Formula |
C10H12O3 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C10H12O3/c1-8(11)13-7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3 |
| InChIKey |
HFNGYHHRRMSKEU-UHFFFAOYSA-N |
| Molecular Weight |
180.203 g/mol |
| Nominal Mass |
180 u |
| Number of Peaks |
116 |
| SMILES |
CC(=O)OCc1ccc(OC)cc1 |
| SPLASH |
splash10-00di-6900000000-cc2d73beb437aece8120 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000084 |
