CID 146049097

2411286-50-3

Structural Information

Molecular Formula
C10H22N2O2
SMILES
CC(C)(C)OC(=O)CCN(C)CCN
InChI
InChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)5-7-12(4)8-6-11/h5-8,11H2,1-4H3
InChIKey
ONBDLQYPEBXVGI-UHFFFAOYSA-N
Compound name
tert-butyl 3-[2-aminoethyl(methyl)amino]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.16812 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.175396 150.5
[M+Na]+ 225.157338 155.2
[M-H]- 201.160844 151.4
[M+NH4]+ 220.201943 169.8
[M+K]+ 241.131278 156.1
[M+H-H2O]+ 185.165380 144.9
[M+HCOO]- 247.166321 173.1
[M+CH3COO]- 261.181971 194.7
[M+Na-2H]- 223.142786 153.5
[M]+ 202.16757142 152.8
[M]- 202.16866858 152.8
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.