CID 11029899

Hexahydro-1h-pyrrolizine-7a-carbonitrile

Structural Information

Molecular Formula
C8H12N2
SMILES
C1CC2(CCCN2C1)C#N
InChI
InChI=1S/C8H12N2/c9-7-8-3-1-5-10(8)6-2-4-8/h1-6H2
InChIKey
DZPUBMXGEQJERB-UHFFFAOYSA-N
Compound name
1,2,3,5,6,7-hexahydropyrrolizine-8-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

136.10005 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.107326 129.4
[M+Na]+ 159.089268 139.5
[M-H]- 135.092774 131.7
[M+NH4]+ 154.133873 153.4
[M+K]+ 175.063208 134.6
[M+H-H2O]+ 119.097310 117.1
[M+HCOO]- 181.098251 146.9
[M+CH3COO]- 195.113901 141.8
[M+Na-2H]- 157.074716 134.2
[M]+ 136.09950142 121.3
[M]- 136.10059858 121.3
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