CID 22492077

Ethyl 2-amino-2-cyclohexylacetate hydrochloride

Structural Information

Molecular Formula
C10H19NO2
SMILES
CCOC(=O)C(C1CCCCC1)N
InChI
InChI=1S/C10H19NO2/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h8-9H,2-7,11H2,1H3
InChIKey
MECSTPOSJXZECH-UHFFFAOYSA-N
Compound name
ethyl 2-amino-2-cyclohexylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

185.14159 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 144.6
[M+Na]+ 208.13081 147.4
[M-H]- 184.13431 146.4
[M+NH4]+ 203.17541 163.3
[M+K]+ 224.10475 146.9
[M+H-H2O]+ 168.13885 138.4
[M+HCOO]- 230.13979 163.5
[M+CH3COO]- 244.15544 183.9
[M+Na-2H]- 206.11626 145.9
[M]+ 185.14104 139.6
[M]- 185.14214 139.6
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