SpectraBase Spectrum ID |
22x131UsVc |
Name |
Methylparaben ME |
CAS Registry Number |
121-98-2 |
Classification |
Preservative |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
166.062994179 u |
Formula |
C9H10O3 |
InChI |
InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3 |
InChIKey |
DDIZAANNODHTRB-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
166.176 g/mol |
SMILES |
c1c(ccc(c1)OC)C(OC)=O |
SPLASH |
splash10-01ri-9600000000-30448ca0d5bf1380e4ae |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_1116 |