CID 58718606

887767-14-8

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)N1CC[C@@H](C1)NCC2CC2
InChI
InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-7-6-11(9-15)14-8-10-4-5-10/h10-11,14H,4-9H2,1-3H3/t11-/m0/s1
InChIKey
BWRDNUFSKYSUOI-NSHDSACASA-N
Compound name
tert-butyl (3S)-3-(cyclopropylmethylamino)pyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

240.18378 Da
Monoisotopic Mass

1.6
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

No patent data available for this compound.