CID 14302

Cyclohexyl carbamate

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1CCC(CC1)OC(=O)N

InChI

InChI=1S/C7H13NO2/c8-7(9)10-6-4-2-1-3-5-6/h6H,1-5H2,(H2,8,9)

InChIKey

AUELWJRRASQDKI-UHFFFAOYSA-N

Compound name

cyclohexyl carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9041
Patents: 143.09464 Da
Monoisotopic Mass: 1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	144.10192	130.4
[M+Na]+	166.08386	134.7
[M-H]-	142.08736	132.7
[M+NH4]+	161.12846	150.9
[M+K]+	182.05780	134.5
[M+H-H2O]+	126.09190	124.7
[M+HCOO]-	188.09284	151.3
[M+CH3COO]-	202.10849	173.8
[M+Na-2H]-	164.06931	134.6
[M]+	143.09409	124.9
[M]-	143.09519	124.9

Literature stripe

literature stripe

Patent stripe

patents stripe