CID 31092
22244-18-4
Structural Information
- Molecular Formula
- C12H16N2O2
- SMILES
- CCCNC(=O)C1CNC2=CC=CC=C2O1
- InChI
- InChI=1S/C12H16N2O2/c1-2-7-13-12(15)11-8-14-9-5-3-4-6-10(9)16-11/h3-6,11,14H,2,7-8H2,1H3,(H,13,15)
- InChIKey
- MNXXJUKTNKKCCX-UHFFFAOYSA-N
- Compound name
- N-propyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 221.12847 | 149.5 |
[M+Na]+ | 243.11041 | 154.8 |
[M-H]- | 219.11391 | 151.2 |
[M+NH4]+ | 238.15501 | 165.1 |
[M+K]+ | 259.08435 | 152.5 |
[M+H-H2O]+ | 203.11845 | 142.2 |
[M+HCOO]- | 265.11939 | 167.0 |
[M+CH3COO]- | 279.13504 | 188.1 |
[M+Na-2H]- | 241.09586 | 156.2 |
[M]+ | 220.12064 | 146.8 |
[M]- | 220.12174 | 146.8 |