CID 3046980
1-propanamine, 3-((1-(4-methoxyphenyl)-4-(4-methylphenyl)-1h-pyrazol-3-yl)oxy)-n,n-dimethyl-,monohydrochloride
Structural Information
- Molecular Formula
- C22H27N3O2
- SMILES
- CC1=CC=C(C=C1)C2=CN(N=C2OCCCN(C)C)C3=CC=C(C=C3)OC
- InChI
- InChI=1S/C22H27N3O2/c1-17-6-8-18(9-7-17)21-16-25(19-10-12-20(26-4)13-11-19)23-22(21)27-15-5-14-24(2)3/h6-13,16H,5,14-15H2,1-4H3
- InChIKey
- QFJZVRDBERKZRP-UHFFFAOYSA-N
- Compound name
- 3-[1-(4-methoxyphenyl)-4-(4-methylphenyl)pyrazol-3-yl]oxy-N,N-dimethylpropan-1-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 366.21761 | 190.5 |
[M+Na]+ | 388.19955 | 197.3 |
[M-H]- | 364.20305 | 199.1 |
[M+NH4]+ | 383.24415 | 202.3 |
[M+K]+ | 404.17349 | 193.2 |
[M+H-H2O]+ | 348.20759 | 179.3 |
[M+HCOO]- | 410.20853 | 213.4 |
[M+CH3COO]- | 424.22418 | 223.7 |
[M+Na-2H]- | 386.18500 | 190.9 |
[M]+ | 365.20978 | 196.3 |
[M]- | 365.21088 | 196.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.