CID 9561445

28058-05-1

Structural Information

Molecular Formula
C14H22N4O2
SMILES
CCCCCCCC/C=N/NC1=NC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C14H22N4O2/c1-2-3-4-5-6-7-8-11-16-17-14-10-9-13(12-15-14)18(19)20/h9-12H,2-8H2,1H3,(H,15,17)/b16-11+
InChIKey
FUNOOJDMPPOHKG-LFIBNONCSA-N
Compound name
5-nitro-N-[(E)-nonylideneamino]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.1743 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.18158 165.4
[M+Na]+ 301.16352 176.0
[M+NH4]+ 296.20812 171.7
[M+K]+ 317.13746 171.1
[M-H]- 277.16702 168.9
[M+Na-2H]- 299.14897 170.7
[M]+ 278.17375 167.5
[M]- 278.17485 167.5
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.