SpectraBase Spectrum ID |
8F8KxQHc5VA |
Name |
Methylparaben AC |
CAS Registry Number |
24262-66-6 |
Classification |
Preservative |
Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
194.057908798 u |
Formula |
C10H10O4 |
InChI |
InChI=1S/C10H10O4/c1-7(11)14-9-5-3-8(4-6-9)10(12)13-2/h3-6H,1-2H3 |
InChIKey |
PGJQPLVEUVHSFQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
194.186 g/mol |
Nominal Mass |
194 u |
Quality |
852 |
Retention Index |
1396 |
SMILES |
C1(C(OC)=O)=CC=C(OC(=O)C)C=C1 |
SPLASH |
splash10-0fk9-1900000000-faccdd80c914d84c2fab |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
methyl 4-(acetyloxy)benzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_002309 |