CID 9576146

28058-24-4

Structural Information

Molecular Formula
C15H14N4O2
SMILES
C/C(=C/C1=CC=CC=C1)/C=N/NC2=NC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C15H14N4O2/c1-12(9-13-5-3-2-4-6-13)10-17-18-15-8-7-14(11-16-15)19(20)21/h2-11H,1H3,(H,16,18)/b12-9-,17-10+
InChIKey
QWRVHDRWRVWUEQ-CVRKYSSXSA-N
Compound name
N-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-5-nitropyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.11166 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.11894 162.9
[M+Na]+ 305.10088 167.3
[M-H]- 281.10438 169.2
[M+NH4]+ 300.14548 175.9
[M+K]+ 321.07482 159.4
[M+H-H2O]+ 265.10892 157.8
[M+HCOO]- 327.10986 189.5
[M+CH3COO]- 341.12551 200.1
[M+Na-2H]- 303.08633 171.1
[M]+ 282.11111 160.1
[M]- 282.11221 160.1
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

No patent data available for this compound.