CID 87596645

2044770-20-7

Structural Information

Molecular Formula
C19H44N4O2
SMILES
CC(CN(CCCN(CCCN(C)C)CCCN(C)C)CC(C)O)O
InChI
InChI=1S/C19H44N4O2/c1-18(24)16-23(17-19(2)25)15-9-14-22(12-7-10-20(3)4)13-8-11-21(5)6/h18-19,24-25H,7-17H2,1-6H3
InChIKey
XOUUBIIWXXBSJN-UHFFFAOYSA-N
Compound name
1-[3-[bis[3-(dimethylamino)propyl]amino]propyl-(2-hydroxypropyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

65
Patents

360.34644 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.35372 197.6
[M+Na]+ 383.33566 199.3
[M+NH4]+ 378.38026 201.3
[M+K]+ 399.30960 196.2
[M-H]- 359.33916 197.1
[M+Na-2H]- 381.32111 196.1
[M]+ 360.34589 196.9
[M]- 360.34699 196.9
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

patents stripe