CID 135547207

302917-97-1

Structural Information

Molecular Formula
C16H14N4O2S
SMILES
CC1=CC=C(S1)C2=CC(=NN2)C(=O)N/N=C/C3=CC=CC=C3O
InChI
InChI=1S/C16H14N4O2S/c1-10-6-7-15(23-10)12-8-13(19-18-12)16(22)20-17-9-11-4-2-3-5-14(11)21/h2-9,21H,1H3,(H,18,19)(H,20,22)/b17-9+
InChIKey
HTTYGWLYPAXOOG-RQZCQDPDSA-N
Compound name
N-[(E)-(2-hydroxyphenyl)methylideneamino]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.08374 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.09102 174.6
[M+Na]+ 349.07296 185.6
[M+NH4]+ 344.11756 180.9
[M+K]+ 365.04690 181.4
[M-H]- 325.07646 178.8
[M+Na-2H]- 347.05841 182.1
[M]+ 326.08319 177.5
[M]- 326.08429 177.5
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.