CID 22273209

850787-22-3

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CCOC(=O)NC1CCC(CC1)N
InChI
InChI=1S/C9H18N2O2/c1-2-13-9(12)11-8-5-3-7(10)4-6-8/h7-8H,2-6,10H2,1H3,(H,11,12)
InChIKey
PVKQEBBQETXXLU-UHFFFAOYSA-N
Compound name
ethyl N-(4-aminocyclohexyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

186.13683 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.144106 142.8
[M+Na]+ 209.126048 146.4
[M-H]- 185.129554 145.0
[M+NH4]+ 204.170653 161.5
[M+K]+ 225.099988 145.6
[M+H-H2O]+ 169.134090 136.4
[M+HCOO]- 231.135031 164.0
[M+CH3COO]- 245.150681 185.5
[M+Na-2H]- 207.111496 145.5
[M]+ 186.13628142 137.5
[M]- 186.13737858 137.5
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