| SpectraBase Spectrum ID |
1MVqFFAj4Tp |
| Name |
Guaiacol |
| CAS Registry Number |
7786-61-0 |
| 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 |
150.068079560 u |
| Formula |
C9H10O2 |
| 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/C9H10O2/c1-3-7-4-5-8(10)9(6-7)11-2/h3-6,10H,1H2,2H3 |
| InChIKey |
YOMSJEATGXXYPX-UHFFFAOYSA-N |
| Molecular Weight |
150.177 g/mol |
| Nominal Mass |
150 u |
| Number of Peaks |
74 |
| SMILES |
Oc1c(cc(cc1)C=C)OC |
| SPLASH |
splash10-0zi9-9800000000-c5cc1117e72caf884457 |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000624 |
