CID 165940571

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

Structural Information

Molecular Formula
C12H26N2O3
SMILES
CC(C)(C)OC(=O)N(C)CCCOCCNC
InChI
InChI=1S/C12H26N2O3/c1-12(2,3)17-11(15)14(5)8-6-9-16-10-7-13-4/h13H,6-10H2,1-5H3
InChIKey
QUSOPPYSTAZFSP-UHFFFAOYSA-N
Compound name
tert-butyl N-methyl-N-[3-[2-(methylamino)ethoxy]propyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.19434 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.20162 162.3
[M+Na]+ 269.18356 166.1
[M-H]- 245.18706 163.3
[M+NH4]+ 264.22816 180.1
[M+K]+ 285.15750 167.5
[M+H-H2O]+ 229.19160 156.0
[M+HCOO]- 291.19254 185.1
[M+CH3COO]- 305.20819 202.8
[M+Na-2H]- 267.16901 165.5
[M]+ 246.19379 167.8
[M]- 246.19489 167.8
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.