CID 34515

2-morpholinocyclohexyl 2,6-dimethylcarbanilate hydrochloride

Structural Information

Molecular Formula
C19H28N2O3
SMILES
CC1=C(C(=CC=C1)C)NC(=O)OC2CCCCC2N3CCOCC3
InChI
InChI=1S/C19H28N2O3/c1-14-6-5-7-15(2)18(14)20-19(22)24-17-9-4-3-8-16(17)21-10-12-23-13-11-21/h5-7,16-17H,3-4,8-13H2,1-2H3,(H,20,22)
InChIKey
MPIGXIWALDQBIY-UHFFFAOYSA-N
Compound name
(2-morpholin-4-ylcyclohexyl) N-(2,6-dimethylphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.21 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.21728 182.7
[M+Na]+ 355.19922 193.3
[M+NH4]+ 350.24382 189.7
[M+K]+ 371.17316 186.9
[M-H]- 331.20272 189.2
[M+Na-2H]- 353.18467 188.0
[M]+ 332.20945 185.8
[M]- 332.21055 185.8
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.