CID 53346638

1289387-44-5

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC1CNC2CC2
InChI
InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-8-4-5-11(15)9-14-10-6-7-10/h10-11,14H,4-9H2,1-3H3
InChIKey
SQRRQAVVRXZUMD-UHFFFAOYSA-N
Compound name
tert-butyl 2-[(cyclopropylamino)methyl]pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

240.18378 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 158.7
[M+Na]+ 263.17300 164.9
[M-H]- 239.17650 164.2
[M+NH4]+ 258.21760 171.9
[M+K]+ 279.14694 162.1
[M+H-H2O]+ 223.18104 152.0
[M+HCOO]- 285.18198 177.9
[M+CH3COO]- 299.19763 196.4
[M+Na-2H]- 261.15845 160.5
[M]+ 240.18323 160.2
[M]- 240.18433 160.2
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