CID 20239

4246-51-9

Structural Information

Molecular Formula
C10H24N2O3
SMILES
C(CN)COCCOCCOCCCN
InChI
InChI=1S/C10H24N2O3/c11-3-1-5-13-7-9-15-10-8-14-6-2-4-12/h1-12H2
InChIKey
JCEZOHLWDIONSP-UHFFFAOYSA-N
Compound name
3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

5
References

10560
Patents

220.1787 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.18598 152.2
[M+Na]+ 243.16792 155.7
[M-H]- 219.17142 150.3
[M+NH4]+ 238.21252 169.4
[M+K]+ 259.14186 155.1
[M+H-H2O]+ 203.17596 145.3
[M+HCOO]- 265.17690 176.1
[M+CH3COO]- 279.19255 193.8
[M+Na-2H]- 241.15337 155.5
[M]+ 220.17815 155.6
[M]- 220.17925 155.6
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