| SpectraBase Spectrum ID |
JVNuw3GpHG5 |
| Name |
3-Chlorobenzaldehyde |
| CAS Registry Number |
587-04-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
140.002892480 u |
| Formula |
C7H5ClO |
| InChI |
InChI=1S/C7H5ClO/c8-7-3-1-2-6(4-7)5-9/h1-5H |
| InChIKey |
SRWILAKSARHZPR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
140.569 g/mol |
| Nominal Mass |
140 u |
| Quality |
938 |
| Retention Index |
1010 |
| SMILES |
C1(C=O)=CC(=CC=C1)Cl |
| SPLASH |
splash10-000f-3900000000-4ac8e0545060ad47d5bb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-chlorobenzaldehyde |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000527 |
