CID 5469564

N'-[(e)-(5-methylthiophen-2-yl)methylidene]pyridine-4-carbohydrazide

Structural Information

Molecular Formula
C12H11N3OS
SMILES
CC1=CC=C(S1)/C=N/NC(=O)C2=CC=NC=C2
InChI
InChI=1S/C12H11N3OS/c1-9-2-3-11(17-9)8-14-15-12(16)10-4-6-13-7-5-10/h2-8H,1H3,(H,15,16)/b14-8+
InChIKey
PWAZOSYCMVBHKQ-RIYZIHGNSA-N
Compound name
N-[(E)-(5-methylthiophen-2-yl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

245.06229 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.06957 153.7
[M+Na]+ 268.05151 161.7
[M-H]- 244.05501 161.0
[M+NH4]+ 263.09611 172.1
[M+K]+ 284.02545 157.9
[M+H-H2O]+ 228.05955 145.7
[M+HCOO]- 290.06049 176.3
[M+CH3COO]- 304.07614 195.6
[M+Na-2H]- 266.03696 156.8
[M]+ 245.06174 155.8
[M]- 245.06284 155.8
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.