CID 53412447
1190322-73-6
Structural Information
- Molecular Formula
- C8H7N3O2
- SMILES
- CC1=CC2=CC(=CN=C2N1)[N+](=O)[O-]
- InChI
- InChI=1S/C8H7N3O2/c1-5-2-6-3-7(11(12)13)4-9-8(6)10-5/h2-4H,1H3,(H,9,10)
- InChIKey
- IWFJRRNZXJEJGF-UHFFFAOYSA-N
- Compound name
- 2-methyl-5-nitro-1H-pyrrolo[2,3-b]pyridine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 178.06111 | 131.5 |
[M+Na]+ | 200.04305 | 145.7 |
[M+NH4]+ | 195.08765 | 139.6 |
[M+K]+ | 216.01699 | 144.2 |
[M-H]- | 176.04655 | 133.6 |
[M+Na-2H]- | 198.02850 | 137.9 |
[M]+ | 177.05328 | 133.9 |
[M]- | 177.05438 | 133.9 |
Literature stripe
No literature data available for this compound.