SpectraBase Spectrum ID |
B3YI6Zi0FG4 |
Name |
Undecanoic acid |
CAS Registry Number |
112-37-8 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
186.161979946 u |
Formula |
C11H22O2 |
InChI |
InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13) |
InChIKey |
ZDPHROOEEOARMN-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
186.295 g/mol |
Nominal Mass |
186 u |
Quality |
972 |
Retention Index |
1290 |
SMILES |
OC(CCCCCCCCCC)=O |
SPLASH |
splash10-022c-9100000000-ff0780bef79f3bb22693 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
undecanoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_006950 |