| SpectraBase Spectrum ID |
2LbJXjBKL2 |
| Name |
Undecanal |
| CAS Registry Number |
112-44-7 |
| 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 |
170.167065327 u |
| Formula |
C11H22O |
| 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/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3 |
| InChIKey |
KMPQYAYAQWNLME-UHFFFAOYSA-N |
| Molecular Weight |
170.296 g/mol |
| Nominal Mass |
170 u |
| Number of Peaks |
79 |
| SMILES |
C(CCCCCC)CCCC=O |
| SPLASH |
splash10-052f-9000000000-83d2f7731054690ad3fe |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA002122 |
