CID 57926959

1159733-63-7

Structural Information

Molecular Formula
C8H9N3
SMILES
CN(C)C1=CN=C(C=C1)C#N
InChI
InChI=1S/C8H9N3/c1-11(2)8-4-3-7(5-9)10-6-8/h3-4,6H,1-2H3
InChIKey
XVVXHYBNPXIIMO-UHFFFAOYSA-N
Compound name
5-(dimethylamino)pyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

147.07965 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.086926 129.9
[M+Na]+ 170.068868 139.5
[M-H]- 146.072374 133.0
[M+NH4]+ 165.113473 148.1
[M+K]+ 186.042808 138.2
[M+H-H2O]+ 130.076910 116.4
[M+HCOO]- 192.077851 151.0
[M+CH3COO]- 206.093501 193.9
[M+Na-2H]- 168.054316 136.9
[M]+ 147.07910142 125.4
[M]- 147.08019858 125.4
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