CID 92683

1,13-diisopropylidene tetraethylene pentamine

Structural Information

Molecular Formula
C14H31N5
SMILES
CC(=NCCNCCNCCNCCN=C(C)C)C
InChI
InChI=1S/C14H31N5/c1-13(2)18-11-9-16-7-5-15-6-8-17-10-12-19-14(3)4/h15-17H,5-12H2,1-4H3
InChIKey
RNSVADAHBNMOEI-UHFFFAOYSA-N
Compound name
N'-[2-(propan-2-ylideneamino)ethyl]-N-[2-[2-(propan-2-ylideneamino)ethylamino]ethyl]ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.25793 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.26521 171.0
[M+Na]+ 292.24715 171.6
[M-H]- 268.25065 172.6
[M+NH4]+ 287.29175 187.1
[M+K]+ 308.22109 171.1
[M+H-H2O]+ 252.25519 162.2
[M+HCOO]- 314.25613 198.4
[M+CH3COO]- 328.27178 220.1
[M+Na-2H]- 290.23260 173.5
[M]+ 269.25738 172.1
[M]- 269.25848 172.1
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.