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

15
Patents

110.0844 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.09168 118.8
[M+Na]+ 133.07362 132.8
[M-H]- 109.07712 125.2
[M+NH4]+ 128.11822 136.5
[M+K]+ 149.04756 128.6
[M+H-H2O]+ 93.081660 109.6
[M+HCOO]- 155.08260 141.4
[M+CH3COO]- 169.09825 188.7
[M+Na-2H]- 131.05907 127.2
[M]+ 110.08385 116.9
[M]- 110.08495 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