CID 31891

Carbamic acid, dicyclohexyl-, 2-(diethylamino)ethyl ester, monohydrochloride

Structural Information

Molecular Formula
C19H36N2O2
SMILES
CCN(CC)CCOC(=O)N(C1CCCCC1)C2CCCCC2
InChI
InChI=1S/C19H36N2O2/c1-3-20(4-2)15-16-23-19(22)21(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h17-18H,3-16H2,1-2H3
InChIKey
XAHGIPKVZPGJAV-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl N,N-dicyclohexylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.27768 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.28496 184.2
[M+Na]+ 347.26690 180.9
[M-H]- 323.27040 190.0
[M+NH4]+ 342.31150 197.7
[M+K]+ 363.24084 180.9
[M+H-H2O]+ 307.27494 174.8
[M+HCOO]- 369.27588 200.8
[M+CH3COO]- 383.29153 218.7
[M+Na-2H]- 345.25235 181.6
[M]+ 324.27713 178.8
[M]- 324.27823 178.8
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.