CID 3067793
Cm 40316
Structural Information
- Molecular Formula
- C15H22N2O2
- SMILES
- CCCC(=O)NCCCC(=O)NCC1=CC=CC=C1
- InChI
- InChI=1S/C15H22N2O2/c1-2-7-14(18)16-11-6-10-15(19)17-12-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,16,18)(H,17,19)
- InChIKey
- UHDIGISIRPCAGX-UHFFFAOYSA-N
- Compound name
- N-benzyl-4-(butanoylamino)butanamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 263.17540 | 164.6 |
[M+Na]+ | 285.15734 | 167.8 |
[M-H]- | 261.16084 | 167.1 |
[M+NH4]+ | 280.20194 | 180.3 |
[M+K]+ | 301.13128 | 165.1 |
[M+H-H2O]+ | 245.16538 | 156.9 |
[M+HCOO]- | 307.16632 | 188.1 |
[M+CH3COO]- | 321.18197 | 202.0 |
[M+Na-2H]- | 283.14279 | 167.7 |
[M]+ | 262.16757 | 165.2 |
[M]- | 262.16867 | 165.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.