CID 10397298

6-(diethylamino)pyridine-3-carbonitrile

Structural Information

Molecular Formula
C10H13N3
SMILES
CCN(CC)C1=NC=C(C=C1)C#N
InChI
InChI=1S/C10H13N3/c1-3-13(4-2)10-6-5-9(7-11)8-12-10/h5-6,8H,3-4H2,1-2H3
InChIKey
SHESZGFVOXMWNO-UHFFFAOYSA-N
Compound name
6-(diethylamino)pyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

175.11095 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.11823 137.9
[M+Na]+ 198.10017 146.7
[M-H]- 174.10367 140.6
[M+NH4]+ 193.14477 155.1
[M+K]+ 214.07411 145.0
[M+H-H2O]+ 158.10821 124.0
[M+HCOO]- 220.10915 158.4
[M+CH3COO]- 234.12480 199.3
[M+Na-2H]- 196.08562 143.9
[M]+ 175.11040 134.1
[M]- 175.11150 134.1
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