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

0
Patents

124.10005 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.10733 129.2
[M+Na]+ 147.08927 136.7
[M-H]- 123.09277 131.6
[M+NH4]+ 142.13387 150.0
[M+K]+ 163.06321 134.5
[M+H-H2O]+ 107.09731 117.1
[M+HCOO]- 169.09825 148.1
[M+CH3COO]- 183.11390 185.6
[M+Na-2H]- 145.07472 132.2
[M]+ 124.09950 119.4
[M]- 124.10060 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

No patent data available for this compound.