CID 669588
N-(4-chlorophenyl)-1,3-benzodioxole-5-carboxamide
Structural Information
- Molecular Formula
- C14H10ClNO3
- SMILES
- C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl
- InChI
- InChI=1S/C14H10ClNO3/c15-10-2-4-11(5-3-10)16-14(17)9-1-6-12-13(7-9)19-8-18-12/h1-7H,8H2,(H,16,17)
- InChIKey
- FDFPTRMBOYUKQW-UHFFFAOYSA-N
- Compound name
- N-(4-chlorophenyl)-1,3-benzodioxole-5-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 276.04218 | 160.0 |
[M+Na]+ | 298.02412 | 168.8 |
[M-H]- | 274.02762 | 169.1 |
[M+NH4]+ | 293.06872 | 176.7 |
[M+K]+ | 313.99806 | 166.2 |
[M+H-H2O]+ | 258.03216 | 154.0 |
[M+HCOO]- | 320.03310 | 177.8 |
[M+CH3COO]- | 334.04875 | 173.0 |
[M+Na-2H]- | 296.00957 | 166.1 |
[M]+ | 275.03435 | 163.7 |
[M]- | 275.03545 | 163.7 |
Literature stripe
Patent stripe
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