CID 51060639
881840-06-8
Structural Information
- Molecular Formula
- C28H26FN5O3
- SMILES
- CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4
- InChI
- InChI=1S/C28H26FN5O3/c1-2-16-37-25-14-10-21(11-15-25)28(36)30-18-26(35)32-31-17-22-19-34(24-6-4-3-5-7-24)33-27(22)20-8-12-23(29)13-9-20/h3-15,17,19H,2,16,18H2,1H3,(H,30,36)(H,32,35)/b31-17+
- InChIKey
- OOARWAURXMRRLA-KBVAKVRCSA-N
- Compound name
- N-[2-[(2E)-2-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 500.20925 | 219.7 |
[M+Na]+ | 522.19119 | 223.4 |
[M-H]- | 498.19469 | 229.6 |
[M+NH4]+ | 517.23579 | 224.1 |
[M+K]+ | 538.16513 | 217.1 |
[M+H-H2O]+ | 482.19923 | 205.3 |
[M+HCOO]- | 544.20017 | 242.3 |
[M+CH3COO]- | 558.21582 | 249.0 |
[M+Na-2H]- | 520.17664 | 219.6 |
[M]+ | 499.20142 | 220.9 |
[M]- | 499.20252 | 220.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.