CID 43251684
2-(4-acetyl-1,4-diazepan-1-yl)ethanamine
Structural Information
- Molecular Formula
- C9H19N3O
- SMILES
- CC(=O)N1CCCN(CC1)CCN
- InChI
- InChI=1S/C9H19N3O/c1-9(13)12-5-2-4-11(6-3-10)7-8-12/h2-8,10H2,1H3
- InChIKey
- RYUJXKQEZJLFDB-UHFFFAOYSA-N
- Compound name
- 1-[4-(2-aminoethyl)-1,4-diazepan-1-yl]ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 186.16010 | 139.4 |
[M+Na]+ | 208.14204 | 142.3 |
[M-H]- | 184.14554 | 140.2 |
[M+NH4]+ | 203.18664 | 154.7 |
[M+K]+ | 224.11598 | 145.6 |
[M+H-H2O]+ | 168.15008 | 131.1 |
[M+HCOO]- | 230.15102 | 156.3 |
[M+CH3COO]- | 244.16667 | 186.1 |
[M+Na-2H]- | 206.12749 | 142.0 |
[M]+ | 185.15227 | 131.8 |
[M]- | 185.15337 | 131.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.