CID 203519

1,1-diphenyl-2-methyl-3-(diisopropylamino)propanol hydrochloride

Structural Information

Molecular Formula
C22H31NO
SMILES
CC(C)N(CC(C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O)C(C)C
InChI
InChI=1S/C22H31NO/c1-17(2)23(18(3)4)16-19(5)22(24,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h6-15,17-19,24H,16H2,1-5H3
InChIKey
VSJMVNMCAXVIMY-UHFFFAOYSA-N
Compound name
3-[di(propan-2-yl)amino]-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.24057 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.247846 183.0
[M+Na]+ 348.229788 184.4
[M-H]- 324.233294 188.3
[M+NH4]+ 343.274393 196.0
[M+K]+ 364.203728 181.8
[M+H-H2O]+ 308.237830 174.8
[M+HCOO]- 370.238771 200.3
[M+CH3COO]- 384.254421 216.7
[M+Na-2H]- 346.215236 183.1
[M]+ 325.24002142 182.6
[M]- 325.24111858 182.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.