CID 9560957

Nsc155263

Structural Information

Molecular Formula
C14H11N3OS
SMILES
C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)/C=N/NC(=S)N
InChI
InChI=1S/C14H11N3OS/c15-14(19)17-16-8-9-5-6-13-11(7-9)10-3-1-2-4-12(10)18-13/h1-8H,(H3,15,17,19)/b16-8+
InChIKey
SWTRTKBZOVCPSB-LZYBPNLTSA-N
Compound name
[(E)-dibenzofuran-2-ylmethylideneamino]thiourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

269.0623 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.06958 156.4
[M+Na]+ 292.05152 166.2
[M-H]- 268.05502 164.2
[M+NH4]+ 287.09612 175.9
[M+K]+ 308.02546 162.1
[M+H-H2O]+ 252.05956 150.1
[M+HCOO]- 314.06050 178.8
[M+CH3COO]- 328.07615 169.7
[M+Na-2H]- 290.03697 163.5
[M]+ 269.06175 159.9
[M]- 269.06285 159.9
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.