CID 58946426

Methyl 3-methoxypyrrolidine-3-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H13NO3
SMILES
COC(=O)C1(CCNC1)OC
InChI
InChI=1S/C7H13NO3/c1-10-6(9)7(11-2)3-4-8-5-7/h8H,3-5H2,1-2H3
InChIKey
IZCZZVPUXSQCCM-UHFFFAOYSA-N
Compound name
methyl 3-methoxypyrrolidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

159.08954 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.09682 133.8
[M+Na]+ 182.07876 140.4
[M-H]- 158.08226 134.4
[M+NH4]+ 177.12336 156.1
[M+K]+ 198.05270 140.2
[M+H-H2O]+ 142.08680 128.8
[M+HCOO]- 204.08774 153.9
[M+CH3COO]- 218.10339 171.0
[M+Na-2H]- 180.06421 138.3
[M]+ 159.08899 132.6
[M]- 159.09009 132.6
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