CID 7109449
303107-74-6
Structural Information
- Molecular Formula
- C17H16N4OS
- SMILES
- CC1=CC=C(S1)C2=CC(=NN2)C(=O)N/N=C(\C)/C3=CC=CC=C3
- InChI
- InChI=1S/C17H16N4OS/c1-11-8-9-16(23-11)14-10-15(20-19-14)17(22)21-18-12(2)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,19,20)(H,21,22)/b18-12+
- InChIKey
- AQUMKPOANNJDPS-LDADJPATSA-N
- Compound name
- 5-(5-methylthiophen-2-yl)-N-[(E)-1-phenylethylideneamino]-1H-pyrazole-3-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 325.11178 | 175.4 |
[M+Na]+ | 347.09372 | 183.8 |
[M-H]- | 323.09722 | 184.4 |
[M+NH4]+ | 342.13832 | 190.5 |
[M+K]+ | 363.06766 | 178.4 |
[M+H-H2O]+ | 307.10176 | 166.9 |
[M+HCOO]- | 369.10270 | 196.5 |
[M+CH3COO]- | 383.11835 | 186.9 |
[M+Na-2H]- | 345.07917 | 175.0 |
[M]+ | 324.10395 | 177.9 |
[M]- | 324.10505 | 177.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.