CID 9568778

Cinnamaldehyde azine

Structural Information

Molecular Formula
C18H16N2
SMILES
C1=CC=C(C=C1)/C=C/C=N/N=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H16N2/c1-3-9-17(10-4-1)13-7-15-19-20-16-8-14-18-11-5-2-6-12-18/h1-16H/b13-7+,14-8+,19-15+,20-16+
InChIKey
MIBXLDBZXACZIE-MKXOLOGGSA-N
Compound name
(E,E)-3-phenyl-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]prop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

260.13135 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.13863 161.3
[M+Na]+ 283.12057 166.9
[M-H]- 259.12407 169.7
[M+NH4]+ 278.16517 178.3
[M+K]+ 299.09451 161.2
[M+H-H2O]+ 243.12861 152.2
[M+HCOO]- 305.12955 190.2
[M+CH3COO]- 319.14520 203.2
[M+Na-2H]- 281.10602 168.9
[M]+ 260.13080 161.0
[M]- 260.13190 161.0
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.