CID 155819340

2228349-76-4

Structural Information

Molecular Formula
C16H30N2O2
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)CCCC2CNC2
InChI
InChI=1S/C16H30N2O2/c1-16(2,3)20-15(19)18-9-5-8-13(12-18)6-4-7-14-10-17-11-14/h13-14,17H,4-12H2,1-3H3
InChIKey
UKOXXWOWCIXEEA-UHFFFAOYSA-N
Compound name
tert-butyl 3-[3-(azetidin-3-yl)propyl]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.23074 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.23802 173.1
[M+Na]+ 305.21996 173.7
[M-H]- 281.22346 173.5
[M+NH4]+ 300.26456 179.0
[M+K]+ 321.19390 174.3
[M+H-H2O]+ 265.22800 159.7
[M+HCOO]- 327.22894 183.2
[M+CH3COO]- 341.24459 200.9
[M+Na-2H]- 303.20541 172.5
[M]+ 282.23019 177.3
[M]- 282.23129 177.3
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.