CID 134129018

Tert-butyl n-[3-(4-aminobutanamido)propyl]carbamate

Structural Information

Molecular Formula
C12H25N3O3
SMILES
CC(C)(C)OC(=O)NCCCNC(=O)CCCN
InChI
InChI=1S/C12H25N3O3/c1-12(2,3)18-11(17)15-9-5-8-14-10(16)6-4-7-13/h4-9,13H2,1-3H3,(H,14,16)(H,15,17)
InChIKey
RZTVTIHLKRTBSD-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(4-aminobutanoylamino)propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.1896 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.19688 164.0
[M+Na]+ 282.17882 167.8
[M+NH4]+ 277.22342 167.8
[M+K]+ 298.15276 165.3
[M-H]- 258.18232 161.6
[M+Na-2H]- 280.16427 163.6
[M]+ 259.18905 163.1
[M]- 259.19015 163.1
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.