| SpectraBase Spectrum ID |
dq6vvVwPI |
| Name |
3,4-Methylenedioxybenzoic acid ME |
| CAS Registry Number |
326-56-7 |
| Classification |
Chemical |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
180.042258734 u |
| Formula |
C9H8O4 |
| InChI |
InChI=1S/C9H8O4/c1-11-9(10)6-2-3-7-8(4-6)13-5-12-7/h2-4H,5H2,1H3 |
| InChIKey |
QCHGUEIECOASJU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
180.159 g/mol |
| SMILES |
c1cc(cc2OCOc12)C(OC)=O |
| SPLASH |
splash10-000t-3900000000-7ad7172e764fb334f81d |
| 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 |
| Synonyms |
Piperonylic acid ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6470 |
