CID 3060421

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

Structural Information

Molecular Formula
C22H27NO
SMILES
CC(CN(CC=C)CC=C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C22H27NO/c1-4-16-23(17-5-2)18-19(3)22(24,20-12-8-6-9-13-20)21-14-10-7-11-15-21/h4-15,19,24H,1-2,16-18H2,3H3
InChIKey
FJMJXOKAMDGLSN-UHFFFAOYSA-N
Compound name
3-[bis(prop-2-enyl)amino]-2-methyl-1,1-diphenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.20926 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.21654 181.5
[M+Na]+ 344.19848 184.1
[M-H]- 320.20198 186.7
[M+NH4]+ 339.24308 194.6
[M+K]+ 360.17242 179.1
[M+H-H2O]+ 304.20652 173.0
[M+HCOO]- 366.20746 201.1
[M+CH3COO]- 380.22311 213.2
[M+Na-2H]- 342.18393 183.9
[M]+ 321.20871 180.9
[M]- 321.20981 180.9
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.