CID 9636782

N'-(9-anthrylmethylene)-4-((4-methylbenzyl)oxy)benzohydrazide

Structural Information

Molecular Formula
C30H24N2O2
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)N/N=C/C3=C4C=CC=CC4=CC5=CC=CC=C53
InChI
InChI=1S/C30H24N2O2/c1-21-10-12-22(13-11-21)20-34-26-16-14-23(15-17-26)30(33)32-31-19-29-27-8-4-2-6-24(27)18-25-7-3-5-9-28(25)29/h2-19H,20H2,1H3,(H,32,33)/b31-19+
InChIKey
OQBCVUZTFXWKSR-ZCTHSVRISA-N
Compound name
N-[(E)-anthracen-9-ylmethylideneamino]-4-[(4-methylphenyl)methoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

444.18378 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 445.19106 210.0
[M+Na]+ 467.17300 216.3
[M-H]- 443.17650 221.8
[M+NH4]+ 462.21760 219.9
[M+K]+ 483.14694 209.0
[M+H-H2O]+ 427.18104 197.3
[M+HCOO]- 489.18198 233.2
[M+CH3COO]- 503.19763 218.7
[M+Na-2H]- 465.15845 216.0
[M]+ 444.18323 212.4
[M]- 444.18433 212.4
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.