CID 16205603
85237-85-0
Structural Information
- Molecular Formula
- C9H13NO5
- SMILES
- CC(=O)CC(=O)C(NC(=O)C)OC(=O)C
- InChI
- InChI=1S/C9H13NO5/c1-5(11)4-8(14)9(10-6(2)12)15-7(3)13/h9H,4H2,1-3H3,(H,10,12)
- InChIKey
- CQCUYOGWLHGGOR-UHFFFAOYSA-N
- Compound name
- (1-acetamido-2,4-dioxopentyl) acetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 216.08666 | 145.6 |
[M+Na]+ | 238.06860 | 150.8 |
[M-H]- | 214.07210 | 145.8 |
[M+NH4]+ | 233.11320 | 163.4 |
[M+K]+ | 254.04254 | 152.2 |
[M+H-H2O]+ | 198.07664 | 140.1 |
[M+HCOO]- | 260.07758 | 166.5 |
[M+CH3COO]- | 274.09323 | 190.8 |
[M+Na-2H]- | 236.05405 | 145.4 |
[M]+ | 215.07883 | 148.3 |
[M]- | 215.07993 | 148.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.