CID 5939566

1033851-93-2

Structural Information

Molecular Formula
C18H16N2O2
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NNC(=O)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H16N2O2/c21-17(13-11-15-7-3-1-4-8-15)19-20-18(22)14-12-16-9-5-2-6-10-16/h1-14H,(H,19,21)(H,20,22)/b13-11+,14-12+
InChIKey
POTPVJOBCXVCJE-PHEQNACWSA-N
Compound name
(E)-3-phenyl-N'-[(E)-3-phenylprop-2-enoyl]prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

292.1212 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.12848 169.7
[M+Na]+ 315.11042 173.6
[M-H]- 291.11392 175.5
[M+NH4]+ 310.15502 183.7
[M+K]+ 331.08436 168.5
[M+H-H2O]+ 275.11846 161.0
[M+HCOO]- 337.11940 194.0
[M+CH3COO]- 351.13505 203.2
[M+Na-2H]- 313.09587 173.9
[M]+ 292.12065 167.1
[M]- 292.12175 167.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe