CID 506879

3-(benzenesulfonyl)-1h-indole-2-carbohydrazide

Structural Information

Molecular Formula
C15H13N3O3S
SMILES
C1=CC=C(C=C1)S(=O)(=O)C2=C(NC3=CC=CC=C32)C(=O)NN
InChI
InChI=1S/C15H13N3O3S/c16-18-15(19)13-14(11-8-4-5-9-12(11)17-13)22(20,21)10-6-2-1-3-7-10/h1-9,17H,16H2,(H,18,19)
InChIKey
LCJUKYVHSZUBCO-UHFFFAOYSA-N
Compound name
3-(benzenesulfonyl)-1H-indole-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

315.06775 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.07503 168.9
[M+Na]+ 338.05697 177.9
[M-H]- 314.06047 174.5
[M+NH4]+ 333.10157 183.8
[M+K]+ 354.03091 172.0
[M+H-H2O]+ 298.06501 162.0
[M+HCOO]- 360.06595 187.1
[M+CH3COO]- 374.08160 202.7
[M+Na-2H]- 336.04242 173.9
[M]+ 315.06720 169.9
[M]- 315.06830 169.9
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.