CID 9813375

[1,4'-bipiperidine]-1'-carbonyl chloride

Structural Information

Molecular Formula
C11H19ClN2O
SMILES
C1CCN(CC1)C2CCN(CC2)C(=O)Cl
InChI
InChI=1S/C11H19ClN2O/c12-11(15)14-8-4-10(5-9-14)13-6-2-1-3-7-13/h10H,1-9H2
InChIKey
YDNSNQRKIINKPV-UHFFFAOYSA-N
Compound name
4-piperidin-1-ylpiperidine-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

381
Patents

230.11859 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.12587 154.1
[M+Na]+ 253.10781 157.3
[M-H]- 229.11131 155.8
[M+NH4]+ 248.15241 169.3
[M+K]+ 269.08175 153.9
[M+H-H2O]+ 213.11585 145.7
[M+HCOO]- 275.11679 162.7
[M+CH3COO]- 289.13244 186.8
[M+Na-2H]- 251.09326 155.0
[M]+ 230.11804 146.7
[M]- 230.11914 146.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe