CID 14959565

Methyl 3-methylpyrrolidine-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1CCNC1C(=O)OC
InChI
InChI=1S/C7H13NO2/c1-5-3-4-8-6(5)7(9)10-2/h5-6,8H,3-4H2,1-2H3
InChIKey
OBTGJTFLRUWIMG-UHFFFAOYSA-N
Compound name
methyl 3-methylpyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
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 131.7
[M+Na]+ 166.08386 140.5
[M+NH4]+ 161.12846 139.0
[M+K]+ 182.05780 138.0
[M-H]- 142.08736 131.0
[M+Na-2H]- 164.06931 134.4
[M]+ 143.09409 132.3
[M]- 143.09519 132.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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