CID 61717320

Ethyl 3-(cyclopropylamino)-2-methylpropanoate

Structural Information

Molecular Formula
C9H17NO2
SMILES
CCOC(=O)C(C)CNC1CC1
InChI
InChI=1S/C9H17NO2/c1-3-12-9(11)7(2)6-10-8-4-5-8/h7-8,10H,3-6H2,1-2H3
InChIKey
GQPJTQFHFDIHDF-UHFFFAOYSA-N
Compound name
ethyl 3-(cyclopropylamino)-2-methylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.12593 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.13321 138.3
[M+Na]+ 194.11515 148.1
[M+NH4]+ 189.15975 146.1
[M+K]+ 210.08909 145.1
[M-H]- 170.11865 145.6
[M+Na-2H]- 192.10060 144.5
[M]+ 171.12538 142.5
[M]- 171.12648 142.5
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

No patent data available for this compound.