CID 9650924

Benzophenone, azine with cinnamaldehyde

Structural Information

Molecular Formula
C22H18N2
SMILES
C1=CC=C(C=C1)/C=C/C=N/N=C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C22H18N2/c1-4-11-19(12-5-1)13-10-18-23-24-22(20-14-6-2-7-15-20)21-16-8-3-9-17-21/h1-18H/b13-10+,23-18+
InChIKey
PBBXNORKHFDZPJ-QSUZBBGVSA-N
Compound name
(E,E)-N-(benzhydrylideneamino)-3-phenylprop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.147 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.154276 175.4
[M+Na]+ 333.136218 179.7
[M-H]- 309.139724 186.4
[M+NH4]+ 328.180823 189.5
[M+K]+ 349.110158 173.5
[M+H-H2O]+ 293.144260 164.7
[M+HCOO]- 355.145201 202.8
[M+CH3COO]- 369.160851 186.2
[M+Na-2H]- 331.121666 182.0
[M]+ 310.14645142 173.7
[M]- 310.14754858 173.7
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.