CID 22931215

1542372-94-0

Structural Information

Molecular Formula
C9H14N2
SMILES
C1CC2CC(CCN2C1)C#N
InChI
InChI=1S/C9H14N2/c10-7-8-3-5-11-4-1-2-9(11)6-8/h8-9H,1-6H2
InChIKey
FMJFHKPQFBKCKZ-UHFFFAOYSA-N
Compound name
1,2,3,5,6,7,8,8a-octahydroindolizine-7-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

150.11569 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.122966 131.2
[M+Na]+ 173.104908 139.6
[M-H]- 149.108414 133.0
[M+NH4]+ 168.149513 151.5
[M+K]+ 189.078848 135.1
[M+H-H2O]+ 133.112950 118.5
[M+HCOO]- 195.113891 146.3
[M+CH3COO]- 209.129541 142.5
[M+Na-2H]- 171.090356 135.4
[M]+ 150.11514142 121.4
[M]- 150.11623858 121.4
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

patents stripe