| SpectraBase Spectrum ID |
3q7XdHltVg |
| Name |
Coumarin<7-hydroxy-4-methyl-> |
| CAS Registry Number |
90-33-5 |
| 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 |
176.047344115 u |
| Formula |
C10H8O3 |
| 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/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3 |
| InChIKey |
HSHNITRMYYLLCV-UHFFFAOYSA-N |
| Molecular Weight |
176.171 g/mol |
| Nominal Mass |
176 u |
| Number of Peaks |
50 |
| SMILES |
Oc1ccc2C(=CC(Oc2c1)=O)C |
| SPLASH |
splash10-0002-6900000000-bbc950b7c244f3bf7e5b |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000373 |
