CID 10907751
Bipymox
Structural Information
- Molecular Formula
- C22H26N4O2
- SMILES
- CC(C)[C@H]1COC(=N1)C2=CC=CC(=N2)C3=NC(=CC=C3)C4=N[C@H](CO4)C(C)C
- InChI
- InChI=1S/C22H26N4O2/c1-13(2)19-11-27-21(25-19)17-9-5-7-15(23-17)16-8-6-10-18(24-16)22-26-20(12-28-22)14(3)4/h5-10,13-14,19-20H,11-12H2,1-4H3/t19-,20-/m1/s1
- InChIKey
- NNCROLGXDLXLJM-WOJBJXKFSA-N
- Compound name
- (4S)-4-propan-2-yl-2-[6-[6-[(4S)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 379.21285 | 192.7 |
[M+Na]+ | 401.19479 | 199.2 |
[M-H]- | 377.19829 | 201.9 |
[M+NH4]+ | 396.23939 | 199.4 |
[M+K]+ | 417.16873 | 196.4 |
[M+H-H2O]+ | 361.20283 | 181.8 |
[M+HCOO]- | 423.20377 | 206.7 |
[M+CH3COO]- | 437.21942 | 201.7 |
[M+Na-2H]- | 399.18024 | 188.4 |
[M]+ | 378.20502 | 194.4 |
[M]- | 378.20612 | 194.4 |
Literature stripe
No literature data available for this compound.