CID 43114993

2-cyclopropyl-2-(methylamino)propanenitrile

Structural Information

Molecular Formula
C7H12N2
SMILES
CC(C#N)(C1CC1)NC
InChI
InChI=1S/C7H12N2/c1-7(5-8,9-2)6-3-4-6/h6,9H,3-4H2,1-2H3
InChIKey
OZLQTEIBZXQTLQ-UHFFFAOYSA-N
Compound name
2-cyclopropyl-2-(methylamino)propanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

124.10005 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.107326 125.0
[M+Na]+ 147.089268 139.0
[M-H]- 123.092774 131.4
[M+NH4]+ 142.133873 142.3
[M+K]+ 163.063208 134.7
[M+H-H2O]+ 107.097310 116.1
[M+HCOO]- 169.098251 146.7
[M+CH3COO]- 183.113901 190.9
[M+Na-2H]- 145.074716 134.2
[M]+ 124.09950142 123.4
[M]- 124.10059858 123.4
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

patents stripe