CID 9588274

2-(5-nitro-2-furyl-1,3-butadienyl)-4-quinolinecarboxaldehyde hydrazone

Structural Information

Molecular Formula
C18H14N4O3
SMILES
C1=CC=C2C(=C1)C(=CC(=N2)/C=C/C=C/C3=CC=C(O3)[N+](=O)[O-])/C=N/N
InChI
InChI=1S/C18H14N4O3/c19-20-12-13-11-14(21-17-8-4-3-7-16(13)17)5-1-2-6-15-9-10-18(25-15)22(23)24/h1-12H,19H2/b5-1+,6-2+,20-12+
InChIKey
YZYDHKTWQAHXGE-NGWFKBEYSA-N
Compound name
(E)-[2-[(1E,3E)-4-(5-nitrofuran-2-yl)buta-1,3-dienyl]quinolin-4-yl]methylidenehydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.1066 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.11388 176.4
[M+Na]+ 357.09582 190.3
[M+NH4]+ 352.14042 182.9
[M+K]+ 373.06976 186.9
[M-H]- 333.09932 183.4
[M+Na-2H]- 355.08127 183.2
[M]+ 334.10605 180.1
[M]- 334.10715 180.1
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.