| SpectraBase Spectrum ID |
3yf0FkavyK6 |
| Name |
Undecanone<2-> |
| CAS Registry Number |
112-12-9 |
| 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/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3 |
| InChIKey |
KYWIYKKSMDLRDC-UHFFFAOYSA-N |
| Molecular Weight |
170.296 g/mol |
| Nominal Mass |
170 u |
| Number of Peaks |
95 |
| SMILES |
C(CCCCCC)CCC(C)=O |
| SPLASH |
splash10-0a4l-9000000000-38ceebd7217241f65f67 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA002131 |
