CID 393336

Nsc695044

Structural Information

Molecular Formula
C12H10N2O3S
SMILES
C1=CC=C(C(=C1)C(=O)NNC(=O)C2=CC=CS2)O
InChI
InChI=1S/C12H10N2O3S/c15-9-5-2-1-4-8(9)11(16)13-14-12(17)10-6-3-7-18-10/h1-7,15H,(H,13,16)(H,14,17)
InChIKey
HERHFFPVTWTXIP-UHFFFAOYSA-N
Compound name
N'-(2-hydroxybenzoyl)thiophene-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

262.0412 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.04848 157.1
[M+Na]+ 285.03042 163.4
[M-H]- 261.03392 163.0
[M+NH4]+ 280.07502 174.4
[M+K]+ 301.00436 159.7
[M+H-H2O]+ 245.03846 150.2
[M+HCOO]- 307.03940 177.2
[M+CH3COO]- 321.05505 192.6
[M+Na-2H]- 283.01587 158.7
[M]+ 262.04065 157.1
[M]- 262.04175 157.1
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

patents stripe