CID 11240433

2-amino-2-cyclopropylacetonitrile hydrochloride

Structural Information

Molecular Formula
C5H8N2
SMILES
C1CC1C(C#N)N
InChI
InChI=1S/C5H8N2/c6-3-5(7)4-1-2-4/h4-5H,1-2,7H2
InChIKey
UFPIFDIPNZPHQK-UHFFFAOYSA-N
Compound name
2-amino-2-cyclopropylacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

96.06875 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 97.076026 115.2
[M+Na]+ 119.057968 129.6
[M-H]- 95.061474 121.3
[M+NH4]+ 114.102573 133.2
[M+K]+ 135.031908 125.3
[M+H-H2O]+ 79.066010 106.2
[M+HCOO]- 141.066951 137.5
[M+CH3COO]- 155.082601 185.5
[M+Na-2H]- 117.043416 123.2
[M]+ 96.06820142 112.1
[M]- 96.06929858 112.1
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