CID 177799555

Methyl (1s,2s)-2-(aminomethyl)-1-methylcyclopropane-1-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
C[C@@]1(C[C@@H]1CN)C(=O)OC
InChI
InChI=1S/C7H13NO2/c1-7(6(9)10-2)3-5(7)4-8/h5H,3-4,8H2,1-2H3/t5-,7+/m1/s1
InChIKey
GILBHUAYXRFKJU-VDTYLAMSSA-N
Compound name
trans-methyl (1S,2S)-2-(aminomethyl)-1-methylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.09464 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 129.9
[M+Na]+ 166.083858 139.5
[M-H]- 142.087364 134.7
[M+NH4]+ 161.128463 148.3
[M+K]+ 182.057798 138.6
[M+H-H2O]+ 126.091900 125.7
[M+HCOO]- 188.092841 153.4
[M+CH3COO]- 202.108491 180.1
[M+Na-2H]- 164.069306 135.5
[M]+ 143.09409142 133.3
[M]- 143.09518858 133.3
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.