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]+ 312.228176 177.8
[M+Na]+ 334.210118 177.5
[M-H]- 310.213624 178.0
[M+NH4]+ 329.254723 187.9
[M+K]+ 350.184058 175.4
[M+H-H2O]+ 294.218160 169.1
[M+HCOO]- 356.219101 187.1
[M+CH3COO]- 370.234751 203.4
[M+Na-2H]- 332.195566 177.0
[M]+ 311.22035142 168.8
[M]- 311.22144858 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.