| SpectraBase Spectrum ID |
4pnMkmce7VJ |
| Name |
Methylparaben |
| Source of Sample |
SAFC Cat. #W271004 |
| CAS Registry Number |
99-76-3 |
| Classification |
Pesticides: Fungicides, Bactericides |
| Comments |
Generally Recognized as Safe; NTIS Accession Number: PB221950 |
| 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 |
152.047344115 u |
| Formula |
C8H8O3 |
| InChI |
InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3 |
| InChIKey |
LXCFILQKKLGQFO-UHFFFAOYSA-N |
| Molecular Weight |
152.149 g/mol |
| Number of Peaks |
37 |
| RI1 |
1495 |
| RI2 |
1435 |
| SMILES |
Oc1ccc(C(=O)OC)cc1 |
| SPLASH |
splash10-00di-5900000000-f17693a254c6562ceac8 |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzoic acid, 4-hydroxy-, methyl ester |
| Wiley ID |
LM_PEST_1091 |
