CID 28279240

4-(morpholin-4-yl)piperidine-4-carbonitrile

Structural Information

Molecular Formula
C10H17N3O
SMILES
C1CNCCC1(C#N)N2CCOCC2
InChI
InChI=1S/C10H17N3O/c11-9-10(1-3-12-4-2-10)13-5-7-14-8-6-13/h12H,1-8H2
InChIKey
GJKMWFATYMRFHV-UHFFFAOYSA-N
Compound name
4-morpholin-4-ylpiperidine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.13716 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.144436 140.0
[M+Na]+ 218.126378 145.7
[M-H]- 194.129884 140.7
[M+NH4]+ 213.170983 154.0
[M+K]+ 234.100318 142.3
[M+H-H2O]+ 178.134420 125.4
[M+HCOO]- 240.135361 149.8
[M+CH3COO]- 254.151011 148.7
[M+Na-2H]- 216.111826 145.6
[M]+ 195.13661142 126.6
[M]- 195.13770858 126.6
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.