| SpectraBase Spectrum ID |
Ev6Elzwef3L |
| Name |
Methyl undecanoate |
| CAS Registry Number |
1731-86-8 |
| 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 |
200.177630011 u |
| Formula |
C12H24O2 |
| 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/C12H24O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-11H2,1-2H3 |
| InChIKey |
XPQPWPZFBULGKT-UHFFFAOYSA-N |
| Molecular Weight |
200.322 g/mol |
| Nominal Mass |
200 u |
| Number of Peaks |
148 |
| SMILES |
C(CCC(OC)=O)CCCCCCC |
| SPLASH |
splash10-00dl-9100000000-989948b967495257de92 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001904 |
