CID 22906251
2-phenyl-7h-pyrrolo[2,3-d]pyrimidine
Structural Information
- Molecular Formula
- C12H9N3
- SMILES
- C1=CC=C(C=C1)C2=NC=C3C=CNC3=N2
- InChI
- InChI=1S/C12H9N3/c1-2-4-9(5-3-1)11-14-8-10-6-7-13-12(10)15-11/h1-8H,(H,13,14,15)
- InChIKey
- HVPMMTIMEHDCTN-UHFFFAOYSA-N
- Compound name
- 2-phenyl-7H-pyrrolo[2,3-d]pyrimidine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 196.08693 | 139.8 |
[M+Na]+ | 218.06887 | 150.4 |
[M-H]- | 194.07237 | 142.7 |
[M+NH4]+ | 213.11347 | 157.1 |
[M+K]+ | 234.04281 | 144.6 |
[M+H-H2O]+ | 178.07691 | 131.0 |
[M+HCOO]- | 240.07785 | 161.4 |
[M+CH3COO]- | 254.09350 | 152.8 |
[M+Na-2H]- | 216.05432 | 149.1 |
[M]+ | 195.07910 | 139.3 |
[M]- | 195.08020 | 139.3 |
Literature stripe
No literature data available for this compound.