CID 2735032
2,2-diphenyl-1-picrylhydrazyl
Structural Information
- Molecular Formula
- C18H12N5O6
- SMILES
- C1=CC=C(C=C1)N(C2=CC=CC=C2)[N]C3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
- InChI
- InChI=1S/C18H12N5O6/c24-21(25)15-11-16(22(26)27)18(17(12-15)23(28)29)19-20(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H
- InChIKey
- HHEAADYXPMHMCT-UHFFFAOYSA-N
- Compound name
- None
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 395.08605 | 188.9 |
[M+Na]+ | 417.06799 | 188.7 |
[M-H]- | 393.07149 | 199.0 |
[M+NH4]+ | 412.11259 | 195.1 |
[M+K]+ | 433.04193 | 175.5 |
[M+H-H2O]+ | 377.07603 | 189.5 |
[M+HCOO]- | 439.07697 | 215.5 |
[M+CH3COO]- | 453.09262 | 214.8 |
[M+Na-2H]- | 415.05344 | 198.5 |
[M]+ | 394.07822 | 184.1 |
[M]- | 394.07932 | 184.1 |