SpectraBase Spectrum ID |
GYcCRy3m9Sa |
Name |
Azelaic acid |
CAS Registry Number |
123-99-9 |
Classification |
Anti-acne |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
188.104858991 u |
Formula |
C9H16O4 |
InChI |
InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13) |
InChIKey |
BDJRBEYXGGNYIS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
188.223 g/mol |
Nominal Mass |
188 u |
Quality |
872 |
Retention Index |
1862 |
SMILES |
OC(CCCCCCCC(=O)O)=O |
SPLASH |
splash10-0nu0-9400000000-04c09318bdd298b7e239 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Nonane diacid
nonanedioic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_012911 |