CID 50986483

Tert-butyl n-[1-(piperidine-4-carbonyl)piperidin-4-yl]carbamate

Structural Information

Molecular Formula
C16H29N3O3
SMILES
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)C2CCNCC2
InChI
InChI=1S/C16H29N3O3/c1-16(2,3)22-15(21)18-13-6-10-19(11-7-13)14(20)12-4-8-17-9-5-12/h12-13,17H,4-11H2,1-3H3,(H,18,21)
InChIKey
AVIZMDYPFAPLEH-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(piperidine-4-carbonyl)piperidin-4-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.2209 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.22818 177.8
[M+Na]+ 334.21012 177.5
[M-H]- 310.21362 178.0
[M+NH4]+ 329.25472 187.9
[M+K]+ 350.18406 175.4
[M+H-H2O]+ 294.21816 169.1
[M+HCOO]- 356.21910 187.1
[M+CH3COO]- 370.23475 203.4
[M+Na-2H]- 332.19557 177.0
[M]+ 311.22035 168.8
[M]- 311.22145 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.