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]+ 322.216536 181.5
[M+Na]+ 344.198478 184.1
[M-H]- 320.201984 186.7
[M+NH4]+ 339.243083 194.6
[M+K]+ 360.172418 179.1
[M+H-H2O]+ 304.206520 173.0
[M+HCOO]- 366.207461 201.1
[M+CH3COO]- 380.223111 213.2
[M+Na-2H]- 342.183926 183.9
[M]+ 321.20871142 180.9
[M]- 321.20980858 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.