CID 267532

102206-77-9

Structural Information

Molecular Formula
C14H17N7
SMILES
CCN(CC)CCNC1=C(C(=C(C(=N1)N)C#N)C#N)C#N
InChI
InChI=1S/C14H17N7/c1-3-21(4-2)6-5-19-14-12(9-17)10(7-15)11(8-16)13(18)20-14/h3-6H2,1-2H3,(H3,18,19,20)
InChIKey
VJGHTKIODVOMJN-UHFFFAOYSA-N
Compound name
2-amino-6-[2-(diethylamino)ethylamino]pyridine-3,4,5-tricarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.15454 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.16182 173.6
[M+Na]+ 306.14376 179.2
[M-H]- 282.14726 176.3
[M+NH4]+ 301.18836 178.8
[M+K]+ 322.11770 178.2
[M+H-H2O]+ 266.15180 159.5
[M+HCOO]- 328.15274 179.0
[M+CH3COO]- 342.16839 245.7
[M+Na-2H]- 304.12921 171.0
[M]+ 283.15399 165.6
[M]- 283.15509 165.6
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

No patent data available for this compound.