CID 34515

29194-99-8

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]+ 333.217276 182.4
[M+Na]+ 355.199218 183.9
[M-H]- 331.202724 189.5
[M+NH4]+ 350.243823 192.4
[M+K]+ 371.173158 181.9
[M+H-H2O]+ 315.207260 172.1
[M+HCOO]- 377.208201 196.3
[M+CH3COO]- 391.223851 211.4
[M+Na-2H]- 353.184666 182.1
[M]+ 332.20945142 176.4
[M]- 332.21054858 176.4
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.