CID 6444921
Brn 1552523
Structural Information
- Molecular Formula
- C22H14N2O4
- SMILES
- C1=CC=C2C=C(C=CC2=C1)/C=C/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-]
- InChI
- InChI=1S/C22H14N2O4/c25-20(12-8-15-7-9-16-4-1-2-5-18(16)14-15)28-22-19(24(26)27)11-10-17-6-3-13-23-21(17)22/h1-14H/b12-8+
- InChIKey
- SGQOYTBLQSLKTD-XYOKQWHBSA-N
- Compound name
- (7-nitroquinolin-8-yl) (E)-3-naphthalen-2-ylprop-2-enoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 371.10265 | 185.9 |
[M+Na]+ | 393.08459 | 192.5 |
[M-H]- | 369.08809 | 192.8 |
[M+NH4]+ | 388.12919 | 196.7 |
[M+K]+ | 409.05853 | 182.6 |
[M+H-H2O]+ | 353.09263 | 179.4 |
[M+HCOO]- | 415.09357 | 207.0 |
[M+CH3COO]- | 429.10922 | 211.0 |
[M+Na-2H]- | 391.07004 | 194.7 |
[M]+ | 370.09482 | 186.9 |
[M]- | 370.09592 | 186.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.