CID 100166
89331-39-5
Structural Information
- Molecular Formula
- C18H20N4O3
- SMILES
- CN(C)N=NC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)O
- InChI
- InChI=1S/C18H20N4O3/c1-22(2)21-20-15-10-8-14(9-11-15)17(23)19-16(18(24)25)12-13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3,(H,19,23)(H,24,25)
- InChIKey
- RRZYNIPFPRIUHP-UHFFFAOYSA-N
- Compound name
- 2-[[4-(dimethylaminodiazenyl)benzoyl]amino]-3-phenylpropanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 341.16081 | 181.2 |
[M+Na]+ | 363.14275 | 189.7 |
[M+NH4]+ | 358.18735 | 186.6 |
[M+K]+ | 379.11669 | 184.9 |
[M-H]- | 339.14625 | 185.9 |
[M+Na-2H]- | 361.12820 | 188.3 |
[M]+ | 340.15298 | 183.2 |
[M]- | 340.15408 | 183.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.