| SpectraBase Spectrum ID |
g6ISXDjF2 |
| Name |
Anisole |
| CAS Registry Number |
18657-09-5 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
162.104465070 u |
| Formula |
C11H14O |
| 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/C11H14O/c1-3-4-5-10-6-8-11(12-2)9-7-10/h4-9H,3H2,1-2H3/b5-4+ |
| InChIKey |
XDQBFRZHMLRPGN-SNAWJCMRSA-N |
| Molecular Weight |
162.232 g/mol |
| Nominal Mass |
162 u |
| Number of Peaks |
94 |
| SMILES |
c1c(ccc(c1)OC)\C=C\CC |
| SPLASH |
splash10-01ot-3900000000-26fd9880748cb8962dbe |
| Source |
ex AMOMUM ULIGINOSUM ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000082 |
