CID 62141993

Methyl 3-cyclobutoxy-2-(methylamino)propanoate hydrochloride

Structural Information

Molecular Formula
C9H17NO3
SMILES
CNC(COC1CCC1)C(=O)OC
InChI
InChI=1S/C9H17NO3/c1-10-8(9(11)12-2)6-13-7-4-3-5-7/h7-8,10H,3-6H2,1-2H3
InChIKey
VUJOCLKIQUEXRN-UHFFFAOYSA-N
Compound name
methyl 3-cyclobutyloxy-2-(methylamino)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.12085 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.12813 143.5
[M+Na]+ 210.11007 146.1
[M-H]- 186.11357 146.2
[M+NH4]+ 205.15467 155.9
[M+K]+ 226.08401 150.0
[M+H-H2O]+ 170.11811 131.8
[M+HCOO]- 232.11905 164.2
[M+CH3COO]- 246.13470 188.4
[M+Na-2H]- 208.09552 146.0
[M]+ 187.12030 152.8
[M]- 187.12140 152.8
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.