CID 9576951
1152-31-4
Structural Information
- Molecular Formula
- C11H11N3O5
- SMILES
- C1=CN=CC=C1C(=O)N/N=C(\CCC(=O)O)/C(=O)O
- InChI
- InChI=1S/C11H11N3O5/c15-9(16)2-1-8(11(18)19)13-14-10(17)7-3-5-12-6-4-7/h3-6H,1-2H2,(H,14,17)(H,15,16)(H,18,19)/b13-8+
- InChIKey
- CCBSJXHUMYNUKH-MDWZMJQESA-N
- Compound name
- (2E)-2-(pyridine-4-carbonylhydrazinylidene)pentanedioic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 266.07718 | 156.1 |
[M+Na]+ | 288.05912 | 160.2 |
[M-H]- | 264.06262 | 156.7 |
[M+NH4]+ | 283.10372 | 169.0 |
[M+K]+ | 304.03306 | 159.3 |
[M+H-H2O]+ | 248.06716 | 148.1 |
[M+HCOO]- | 310.06810 | 177.2 |
[M+CH3COO]- | 324.08375 | 197.0 |
[M+Na-2H]- | 286.04457 | 158.9 |
[M]+ | 265.06935 | 155.4 |
[M]- | 265.07045 | 155.4 |