CID 503279
Propyl 2-chloro-5-[(2-methylbenzoyl)amino]benzoate
Structural Information
- Molecular Formula
- C18H18ClNO3
- SMILES
- CCCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2C)Cl
- InChI
- InChI=1S/C18H18ClNO3/c1-3-10-23-18(22)15-11-13(8-9-16(15)19)20-17(21)14-7-5-4-6-12(14)2/h4-9,11H,3,10H2,1-2H3,(H,20,21)
- InChIKey
- LOTPCTPCZAGFIT-UHFFFAOYSA-N
- Compound name
- propyl 2-chloro-5-[(2-methylbenzoyl)amino]benzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 332.10481 | 176.1 |
[M+Na]+ | 354.08675 | 183.7 |
[M-H]- | 330.09025 | 182.9 |
[M+NH4]+ | 349.13135 | 190.7 |
[M+K]+ | 370.06069 | 178.7 |
[M+H-H2O]+ | 314.09479 | 168.9 |
[M+HCOO]- | 376.09573 | 194.8 |
[M+CH3COO]- | 390.11138 | 211.0 |
[M+Na-2H]- | 352.07220 | 177.5 |
[M]+ | 331.09698 | 181.0 |
[M]- | 331.09808 | 181.0 |
Literature stripe
No literature data available for this compound.