CID 3069764
Brn 5610070
Structural Information
- Molecular Formula
- C22H27N3O2
- SMILES
- CC(C)(C)NCC(COC1=CC=CC=C1C(=C)N2C=NC3=CC=CC=C32)O
- InChI
- InChI=1S/C22H27N3O2/c1-16(25-15-23-19-10-6-7-11-20(19)25)18-9-5-8-12-21(18)27-14-17(26)13-24-22(2,3)4/h5-12,15,17,24,26H,1,13-14H2,2-4H3
- InChIKey
- HAAUBVPBGJLBEO-UHFFFAOYSA-N
- Compound name
- 1-[2-[1-(benzimidazol-1-yl)ethenyl]phenoxy]-3-(tert-butylamino)propan-2-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 366.21761 | 191.3 |
[M+Na]+ | 388.19955 | 196.9 |
[M-H]- | 364.20305 | 195.0 |
[M+NH4]+ | 383.24415 | 202.7 |
[M+K]+ | 404.17349 | 191.6 |
[M+H-H2O]+ | 348.20759 | 182.2 |
[M+HCOO]- | 410.20853 | 208.7 |
[M+CH3COO]- | 424.22418 | 217.9 |
[M+Na-2H]- | 386.18500 | 193.9 |
[M]+ | 365.20978 | 193.7 |
[M]- | 365.21088 | 193.7 |
Literature stripe
Patent stripe
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