CID 13437377

2-(cyclopropylamino)propanenitrile hydrochloride

Structural Information

Molecular Formula
C6H10N2
SMILES
CC(C#N)NC1CC1
InChI
InChI=1S/C6H10N2/c1-5(4-7)8-6-2-3-6/h5-6,8H,2-3H2,1H3
InChIKey
UMMIQMAIGBATCS-UHFFFAOYSA-N
Compound name
2-(cyclopropylamino)propanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

110.0844 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.091676 118.8
[M+Na]+ 133.073618 132.8
[M-H]- 109.077124 125.2
[M+NH4]+ 128.118223 136.5
[M+K]+ 149.047558 128.6
[M+H-H2O]+ 93.081660 109.6
[M+HCOO]- 155.082601 141.4
[M+CH3COO]- 169.098251 188.7
[M+Na-2H]- 131.059066 127.2
[M]+ 110.08385142 116.9
[M]- 110.08494858 116.9
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