CID 165942533

Tert-butyl n-{3-[2-(methylamino)ethoxy]propyl}carbamate

Structural Information

Molecular Formula
C11H24N2O3
SMILES
CC(C)(C)OC(=O)NCCCOCCNC
InChI
InChI=1S/C11H24N2O3/c1-11(2,3)16-10(14)13-6-5-8-15-9-7-12-4/h12H,5-9H2,1-4H3,(H,13,14)
InChIKey
QBKPBYCIWHBARF-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-[2-(methylamino)ethoxy]propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

232.1787 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.18598 157.7
[M+Na]+ 255.16792 161.7
[M-H]- 231.17142 157.4
[M+NH4]+ 250.21252 175.3
[M+K]+ 271.14186 161.9
[M+H-H2O]+ 215.17596 151.7
[M+HCOO]- 277.17690 180.3
[M+CH3COO]- 291.19255 196.3
[M+Na-2H]- 253.15337 162.1
[M]+ 232.17815 161.5
[M]- 232.17925 161.5
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