CID 155821381

2445800-59-7

Structural Information

Molecular Formula
C13H24N2O2
SMILES
CC(C)(C)OC(=O)NCCC12CCC1CNC2
InChI
InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-7-6-13-5-4-10(13)8-14-9-13/h10,14H,4-9H2,1-3H3,(H,15,16)
InChIKey
MJCRRXNEGIXMFJ-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(3-azabicyclo[3.2.0]heptan-1-yl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.18378 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.19106 162.3
[M+Na]+ 263.17300 164.8
[M-H]- 239.17650 163.0
[M+NH4]+ 258.21760 175.7
[M+K]+ 279.14694 165.8
[M+H-H2O]+ 223.18104 152.2
[M+HCOO]- 285.18198 177.5
[M+CH3COO]- 299.19763 193.7
[M+Na-2H]- 261.15845 165.5
[M]+ 240.18323 168.8
[M]- 240.18433 168.8
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.