CID 6395359
Betaine aldehyde hydrate
Structural Information
- Molecular Formula
- C5H14NO2
- SMILES
- C[N+](C)(C)CC(O)O
- InChI
- InChI=1S/C5H14NO2/c1-6(2,3)4-5(7)8/h5,7-8H,4H2,1-3H3/q+1
- InChIKey
- HEHORKLRCFPRON-UHFFFAOYSA-N
- Compound name
- 2,2-dihydroxyethyl(trimethyl)azanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 121.10973 | 121.6 |
[M+Na]+ | 143.09167 | 128.2 |
[M-H]- | 119.09518 | 121.3 |
[M+NH4]+ | 138.13628 | 143.3 |
[M+K]+ | 159.06561 | 123.4 |
[M+H-H2O]+ | 103.09972 | 120.8 |
[M+HCOO]- | 165.10066 | 142.8 |
[M+CH3COO]- | 179.11631 | 164.4 |
[M+Na-2H]- | 141.07712 | 130.9 |
[M]+ | 120.10191 | 119.8 |
[M]- | 120.10300 | 119.8 |