CID 9668639

2-iodo-n'-(3-methoxybenzylidene)benzohydrazide

Structural Information

Molecular Formula
C15H13IN2O2
SMILES
COC1=CC=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2I
InChI
InChI=1S/C15H13IN2O2/c1-20-12-6-4-5-11(9-12)10-17-18-15(19)13-7-2-3-8-14(13)16/h2-10H,1H3,(H,18,19)/b17-10+
InChIKey
COSHONNGMLUXGA-LICLKQGHSA-N
Compound name
2-iodo-N-[(E)-(3-methoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.00217 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.00945 175.9
[M+Na]+ 402.99139 175.4
[M-H]- 378.99489 176.4
[M+NH4]+ 398.03599 187.0
[M+K]+ 418.96533 178.0
[M+H-H2O]+ 362.99943 163.5
[M+HCOO]- 425.00037 197.3
[M+CH3COO]- 439.01602 211.7
[M+Na-2H]- 400.97684 168.9
[M]+ 380.00162 174.2
[M]- 380.00272 174.2
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.