CID 13822996

Tert-butyl 2-methylpyrrolidine-2-carboxylate

Structural Information

Molecular Formula
C10H19NO2
SMILES
CC1(CCCN1)C(=O)OC(C)(C)C
InChI
InChI=1S/C10H19NO2/c1-9(2,3)13-8(12)10(4)6-5-7-11-10/h11H,5-7H2,1-4H3
InChIKey
WAOBLRSJQYXNJU-UHFFFAOYSA-N
Compound name
tert-butyl 2-methylpyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

185.14159 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.148866 144.4
[M+Na]+ 208.130808 150.3
[M-H]- 184.134314 144.9
[M+NH4]+ 203.175413 166.1
[M+K]+ 224.104748 149.5
[M+H-H2O]+ 168.138850 140.0
[M+HCOO]- 230.139791 161.8
[M+CH3COO]- 244.155441 177.6
[M+Na-2H]- 206.116256 148.2
[M]+ 185.14104142 142.4
[M]- 185.14213858 142.4
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