CID 14405752

2-amino-3-hydroxy-2-methylpropanenitrile hydrochloride

Structural Information

Molecular Formula
C4H8N2O
SMILES
CC(CO)(C#N)N
InChI
InChI=1S/C4H8N2O/c1-4(6,2-5)3-7/h7H,3,6H2,1H3
InChIKey
FSRLLJVJCVKHQI-UHFFFAOYSA-N
Compound name
2-amino-3-hydroxy-2-methylpropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

100.06366 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.07094 121.3
[M+Na]+ 123.05288 129.7
[M+NH4]+ 118.09748 125.3
[M+K]+ 139.02682 123.2
[M-H]- 99.056384 113.2
[M+Na-2H]- 121.03833 122.5
[M]+ 100.06311 119.1
[M]- 100.06421 119.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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