| SpectraBase Spectrum ID |
JJY0t3VfvCi |
| Name |
3-Methoxybenzoylchloride |
| CAS Registry Number |
1711-05-3 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); 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/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3 |
| InChIKey |
RUQIUASLAXJZIE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
170.595 g/mol |
| Nominal Mass |
170 u |
| Quality |
1000 |
| Retention Index |
1297 |
| SMILES |
C=1(C(Cl)=O)C=C(C=CC1)OC |
| SPLASH |
splash10-000i-6900000000-fe5ebcd0fc83560d7396 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-Anisoyl chloride
Benzoyl chloride,3-methoxy
3-methoxybenzoyl chloride |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022599 |
