CID 3059997
77562-90-4
Structural Information
- Molecular Formula
- C20H27N3
- SMILES
- CC(CN1CCN(CC1)CC2=CC=CC=C2)NC3=CC=CC=C3
- InChI
- InChI=1S/C20H27N3/c1-18(21-20-10-6-3-7-11-20)16-22-12-14-23(15-13-22)17-19-8-4-2-5-9-19/h2-11,18,21H,12-17H2,1H3
- InChIKey
- ICGRWRFQVRVQIH-UHFFFAOYSA-N
- Compound name
- N-[1-(4-benzylpiperazin-1-yl)propan-2-yl]aniline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 310.22778 | 176.6 |
[M+Na]+ | 332.20972 | 178.5 |
[M-H]- | 308.21322 | 181.5 |
[M+NH4]+ | 327.25432 | 187.1 |
[M+K]+ | 348.18366 | 172.9 |
[M+H-H2O]+ | 292.21776 | 165.1 |
[M+HCOO]- | 354.21870 | 193.2 |
[M+CH3COO]- | 368.23435 | 184.6 |
[M+Na-2H]- | 330.19517 | 179.7 |
[M]+ | 309.21995 | 170.7 |
[M]- | 309.22105 | 170.7 |
Literature stripe
No literature data available for this compound.