CID 312444
17788-27-1
Structural Information
- Molecular Formula
- C13H18N2O3
- SMILES
- CCC(=O)NC1=CC(=CC=C1)OC(=O)NC(C)C
- InChI
- InChI=1S/C13H18N2O3/c1-4-12(16)15-10-6-5-7-11(8-10)18-13(17)14-9(2)3/h5-9H,4H2,1-3H3,(H,14,17)(H,15,16)
- InChIKey
- ZZROZXYQSJYQJQ-UHFFFAOYSA-N
- Compound name
- [3-(propanoylamino)phenyl] N-propan-2-ylcarbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 251.13902 | 158.8 |
[M+Na]+ | 273.12096 | 163.5 |
[M-H]- | 249.12446 | 162.2 |
[M+NH4]+ | 268.16556 | 175.3 |
[M+K]+ | 289.09490 | 162.6 |
[M+H-H2O]+ | 233.12900 | 151.6 |
[M+HCOO]- | 295.12994 | 182.2 |
[M+CH3COO]- | 309.14559 | 199.5 |
[M+Na-2H]- | 271.10641 | 161.0 |
[M]+ | 250.13119 | 159.7 |
[M]- | 250.13229 | 159.7 |
Literature stripe
No literature data available for this compound.