CID 11287789

Ethyl 2-amino-3-cyclohexylpropanoate hydrochloride

Structural Information

Molecular Formula
C11H21NO2
SMILES
CCOC(=O)C(CC1CCCCC1)N
InChI
InChI=1S/C11H21NO2/c1-2-14-11(13)10(12)8-9-6-4-3-5-7-9/h9-10H,2-8,12H2,1H3
InChIKey
NYJXAHCVTRDWEF-UHFFFAOYSA-N
Compound name
ethyl 2-amino-3-cyclohexylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

199.15723 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.164506 149.2
[M+Na]+ 222.146448 151.5
[M-H]- 198.149954 150.8
[M+NH4]+ 217.191053 167.3
[M+K]+ 238.120388 150.8
[M+H-H2O]+ 182.154490 142.8
[M+HCOO]- 244.155431 167.7
[M+CH3COO]- 258.171081 186.9
[M+Na-2H]- 220.131896 149.9
[M]+ 199.15668142 144.5
[M]- 199.15777858 144.5
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