CID 62070564

2-amino-2-cyclopentylacetonitrile hydrochloride

Structural Information

Molecular Formula
C7H12N2
SMILES
C1CCC(C1)C(C#N)N
InChI
InChI=1S/C7H12N2/c8-5-7(9)6-3-1-2-4-6/h6-7H,1-4,9H2
InChIKey
WOPVVVYENHYREL-UHFFFAOYSA-N
Compound name
2-amino-2-cyclopentylacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

124.10005 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.107326 129.2
[M+Na]+ 147.089268 136.7
[M-H]- 123.092774 131.6
[M+NH4]+ 142.133873 150.0
[M+K]+ 163.063208 134.5
[M+H-H2O]+ 107.097310 117.1
[M+HCOO]- 169.098251 148.1
[M+CH3COO]- 183.113901 185.6
[M+Na-2H]- 145.074716 132.2
[M]+ 124.09950142 119.4
[M]- 124.10059858 119.4
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