CID 82594757

4-cyclopropylpiperidine-4-carbonitrile

Structural Information

Molecular Formula
C9H14N2
SMILES
C1CC1C2(CCNCC2)C#N
InChI
InChI=1S/C9H14N2/c10-7-9(8-1-2-8)3-5-11-6-4-9/h8,11H,1-6H2
InChIKey
DJOIAVBIPWQCSU-UHFFFAOYSA-N
Compound name
4-cyclopropylpiperidine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.11569 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.12297 131.7
[M+Na]+ 173.10491 145.0
[M-H]- 149.10841 137.3
[M+NH4]+ 168.14951 147.8
[M+K]+ 189.07885 138.5
[M+H-H2O]+ 133.11295 122.1
[M+HCOO]- 195.11389 148.5
[M+CH3COO]- 209.12954 144.0
[M+Na-2H]- 171.09036 139.5
[M]+ 150.11514 125.2
[M]- 150.11624 125.2
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.