CID 84938

Bis(4-aminocyclohexyl)methyl carbamate

Structural Information

Molecular Formula
C14H27N3O2
SMILES
C1CC(CCC1C(C2CCC(CC2)N)OC(=O)N)N
InChI
InChI=1S/C14H27N3O2/c15-11-5-1-9(2-6-11)13(19-14(17)18)10-3-7-12(16)8-4-10/h9-13H,1-8,15-16H2,(H2,17,18)
InChIKey
WTRTWNXSQAXYMT-UHFFFAOYSA-N
Compound name
bis(4-aminocyclohexyl)methyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

269.21033 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.21761 165.8
[M+Na]+ 292.19955 170.4
[M+NH4]+ 287.24415 172.2
[M+K]+ 308.17349 166.8
[M-H]- 268.20305 169.2
[M+Na-2H]- 290.18500 167.5
[M]+ 269.20978 166.6
[M]- 269.21088 166.6
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