CID 76179868

Tert-butyl n-[6-(methylamino)hexyl]carbamate

Structural Information

Molecular Formula
C12H26N2O2
SMILES
CC(C)(C)OC(=O)NCCCCCCNC
InChI
InChI=1S/C12H26N2O2/c1-12(2,3)16-11(15)14-10-8-6-5-7-9-13-4/h13H,5-10H2,1-4H3,(H,14,15)
InChIKey
ZNZSUZGLIJORGM-UHFFFAOYSA-N
Compound name
tert-butyl N-[6-(methylamino)hexyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

230.19943 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.20671 158.4
[M+Na]+ 253.18865 164.6
[M+NH4]+ 248.23325 164.0
[M+K]+ 269.16259 160.1
[M-H]- 229.19215 157.1
[M+Na-2H]- 251.17410 159.8
[M]+ 230.19888 158.5
[M]- 230.19998 158.5
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