| SpectraBase Spectrum ID |
CoRbgkvviyO |
| Name |
3,4-Methylenedioxycinnamic acid |
| CAS Registry Number |
2373-80-0 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
192.042258734 u |
| Formula |
C10H8O4 |
| InChI |
InChI=1S/C10H8O4/c11-10(12)4-2-7-1-3-8-9(5-7)14-6-13-8/h1-5H,6H2,(H,11,12)/b4-2- |
| InChIKey |
QFQYZMGOKIROEC-RQOWECAXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
192.170 g/mol |
| Nominal Mass |
192 u |
| Quality |
993 |
| Retention Index |
1426 |
| SMILES |
OC(\C=C/C1=CC2=C(C=C1)OCO2)=O |
| SPLASH |
splash10-0006-8900000000-4904b516a042d6d9cdfe |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(1,3-benzodioxol-5-yl)prop-2-enoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002128 |
