CID 116861262

Tert-butyl n-[2-(methylamino)butyl]carbamate

Structural Information

Molecular Formula
C10H22N2O2
SMILES
CCC(CNC(=O)OC(C)(C)C)NC
InChI
InChI=1S/C10H22N2O2/c1-6-8(11-5)7-12-9(13)14-10(2,3)4/h8,11H,6-7H2,1-5H3,(H,12,13)
InChIKey
GGDOOVFOLZYTPM-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(methylamino)butyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

202.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.17540 150.9
[M+Na]+ 225.15734 155.2
[M-H]- 201.16084 150.9
[M+NH4]+ 220.20194 169.8
[M+K]+ 241.13128 155.6
[M+H-H2O]+ 185.16538 145.5
[M+HCOO]- 247.16632 172.6
[M+CH3COO]- 261.18197 192.1
[M+Na-2H]- 223.14279 154.5
[M]+ 202.16757 152.2
[M]- 202.16867 152.2
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