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

4
Patents

150.11569 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.12297 131.2
[M+Na]+ 173.10491 139.6
[M-H]- 149.10841 133.0
[M+NH4]+ 168.14951 151.5
[M+K]+ 189.07885 135.1
[M+H-H2O]+ 133.11295 118.5
[M+HCOO]- 195.11389 146.3
[M+CH3COO]- 209.12954 142.5
[M+Na-2H]- 171.09036 135.4
[M]+ 150.11514 121.4
[M]- 150.11624 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