CID 9579158

N-benzo[b]thiophen-7-ylmethyl-n'-(4-fluoro-benzylidene)-n-methyl-hydrazine

Structural Information

Molecular Formula
C17H15FN2S
SMILES
CN(CC1=CC=CC2=C1SC=C2)/N=C\C3=CC=C(C=C3)F
InChI
InChI=1S/C17H15FN2S/c1-20(19-11-13-5-7-16(18)8-6-13)12-15-4-2-3-14-9-10-21-17(14)15/h2-11H,12H2,1H3/b19-11-
InChIKey
XWWBNPJIGSIBCE-ODLFYWEKSA-N
Compound name
1-(1-benzothiophen-7-yl)-N-[(Z)-(4-fluorophenyl)methylideneamino]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

298.094 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.10128 166.3
[M+Na]+ 321.08322 175.8
[M-H]- 297.08672 175.9
[M+NH4]+ 316.12782 185.9
[M+K]+ 337.05716 170.7
[M+H-H2O]+ 281.09126 157.6
[M+HCOO]- 343.09220 189.8
[M+CH3COO]- 357.10785 179.4
[M+Na-2H]- 319.06867 170.1
[M]+ 298.09345 170.7
[M]- 298.09455 170.7
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

No patent data available for this compound.