| SpectraBase Spectrum ID |
JElD4Ftt46a |
| Name |
3,4-Methylenedioxybenzyl chloride |
| CAS Registry Number |
20850-43-5 |
| Classification |
Chemical |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
170.013457163 u |
| Formula |
C8H7ClO2 |
| InChI |
InChI=1S/C8H7ClO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,4-5H2 |
| InChIKey |
DWSUJONSJJTODA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
170.595 g/mol |
| Nominal Mass |
170 u |
| Quality |
999 |
| Retention Index |
1533 |
| SMILES |
C1=2C(=CC=C(C2)CCl)OCO1 |
| SPLASH |
splash10-000i-5900000000-78f3ea3e885b07fda558 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-(chloromethyl)-1,3-benzodioxole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_032183 |
