CID 45072268

Tert-butyl n-[1-(piperidin-4-yl)azetidin-3-yl]carbamate

Structural Information

Molecular Formula
C13H25N3O2
SMILES
CC(C)(C)OC(=O)NC1CN(C1)C2CCNCC2
InChI
InChI=1S/C13H25N3O2/c1-13(2,3)18-12(17)15-10-8-16(9-10)11-4-6-14-7-5-11/h10-11,14H,4-9H2,1-3H3,(H,15,17)
InChIKey
DEZXAIJGUDCVNH-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-piperidin-4-ylazetidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.19467 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.201946 164.7
[M+Na]+ 278.183888 165.5
[M-H]- 254.187394 165.5
[M+NH4]+ 273.228493 171.2
[M+K]+ 294.157828 166.9
[M+H-H2O]+ 238.191930 151.0
[M+HCOO]- 300.192871 176.7
[M+CH3COO]- 314.208521 197.0
[M+Na-2H]- 276.169336 165.9
[M]+ 255.19412142 167.0
[M]- 255.19521858 167.0
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.