CID 5335112

351443-63-5

Structural Information

Molecular Formula
C16H14FN3O2
SMILES
CC1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CC=C(C=C2)F
InChI
InChI=1S/C16H14FN3O2/c1-11-2-8-14(9-3-11)19-15(21)16(22)20-18-10-12-4-6-13(17)7-5-12/h2-10H,1H3,(H,19,21)(H,20,22)/b18-10+
InChIKey
SDZPRVGQTPIWTR-VCHYOVAHSA-N
Compound name
N'-[(E)-(4-fluorophenyl)methylideneamino]-N-(4-methylphenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.107 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.11428 167.9
[M+Na]+ 322.09622 173.8
[M-H]- 298.09972 174.7
[M+NH4]+ 317.14082 182.5
[M+K]+ 338.07016 170.3
[M+H-H2O]+ 282.10426 158.1
[M+HCOO]- 344.10520 194.1
[M+CH3COO]- 358.12085 211.3
[M+Na-2H]- 320.08167 172.0
[M]+ 299.10645 166.3
[M]- 299.10755 166.3
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.