CID 11040803

Methyl (2s)-2-amino-3-cyclopropylpropanoate

Structural Information

Molecular Formula
C7H13NO2
SMILES
COC(=O)[C@H](CC1CC1)N
InChI
InChI=1S/C7H13NO2/c1-10-7(9)6(8)4-5-2-3-5/h5-6H,2-4,8H2,1H3/t6-/m0/s1
InChIKey
FNMJQKSDSQUBJY-LURJTMIESA-N
Compound name
methyl (2S)-2-amino-3-cyclopropylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

160
Patents

143.09464 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 130.0
[M+Na]+ 166.08386 137.9
[M-H]- 142.08736 134.2
[M+NH4]+ 161.12846 146.2
[M+K]+ 182.05780 136.5
[M+H-H2O]+ 126.09190 124.2
[M+HCOO]- 188.09284 153.1
[M+CH3COO]- 202.10849 180.3
[M+Na-2H]- 164.06931 134.1
[M]+ 143.09409 132.0
[M]- 143.09519 132.0
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