CID 469939

N'-isopropyl-n-[2-[isopropyl-[2-(isopropylamino)ethyl]amino]ethyl]ethane-1,2-diamine

Structural Information

Molecular Formula
C15H36N4
SMILES
CC(C)NCCNCCN(CCNC(C)C)C(C)C
InChI
InChI=1S/C15H36N4/c1-13(2)17-8-7-16-9-11-19(15(5)6)12-10-18-14(3)4/h13-18H,7-12H2,1-6H3
InChIKey
XTZPESIQIMXFGJ-UHFFFAOYSA-N
Compound name
N'-propan-2-yl-N-[2-[propan-2-yl-[2-(propan-2-ylamino)ethyl]amino]ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

272.294 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.30128 177.9
[M+Na]+ 295.28322 177.4
[M-H]- 271.28672 178.0
[M+NH4]+ 290.32782 193.4
[M+K]+ 311.25716 177.8
[M+H-H2O]+ 255.29126 169.7
[M+HCOO]- 317.29220 200.1
[M+CH3COO]- 331.30785 220.2
[M+Na-2H]- 293.26867 176.2
[M]+ 272.29345 178.5
[M]- 272.29455 178.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe