CID 15561927

(2-aminopropyl)(ethyl)amine

Structural Information

Molecular Formula
C5H14N2
SMILES
CCNCC(C)N
InChI
InChI=1S/C5H14N2/c1-3-7-4-5(2)6/h5,7H,3-4,6H2,1-2H3
InChIKey
RFWLRDUNLTZRIQ-UHFFFAOYSA-N
Compound name
1-N-ethylpropane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

102.1157 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.12298 123.4
[M+Na]+ 125.10492 129.1
[M-H]- 101.10842 123.3
[M+NH4]+ 120.14952 145.8
[M+K]+ 141.07886 129.1
[M+H-H2O]+ 85.112960 118.4
[M+HCOO]- 147.11390 147.9
[M+CH3COO]- 161.12955 173.9
[M+Na-2H]- 123.09037 129.0
[M]+ 102.11515 120.9
[M]- 102.11625 120.9
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