| SpectraBase Spectrum ID |
EI4XCGAboqZ |
| Name |
Safranal |
| CAS Registry Number |
116-26-7 |
| 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 |
150.104465070 u |
| Formula |
C10H14O |
| 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/C10H14O/c1-8-5-4-6-10(2,3)9(8)7-11/h4-5,7H,6H2,1-3H3 |
| InChIKey |
SGAWOGXMMPSZPB-UHFFFAOYSA-N |
| Molecular Weight |
150.221 g/mol |
| Nominal Mass |
150 u |
| Number of Peaks |
105 |
| SMILES |
C(=O)C=1C(C)(C)CC=CC1C |
| SPLASH |
splash10-0a4l-9700000000-7a19fcff2955bf1cc7c9 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA002052 |
