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]+ 326.24785 183.0
[M+Na]+ 348.22979 184.4
[M-H]- 324.23329 188.3
[M+NH4]+ 343.27439 196.0
[M+K]+ 364.20373 181.8
[M+H-H2O]+ 308.23783 174.8
[M+HCOO]- 370.23877 200.3
[M+CH3COO]- 384.25442 216.7
[M+Na-2H]- 346.21524 183.1
[M]+ 325.24002 182.6
[M]- 325.24112 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.