CID 9601307

N'-(2-furylmethylene)-4-methylbenzenesulfonohydrazide

Structural Information

Molecular Formula
C12H12N2O3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC=CO2
InChI
InChI=1S/C12H12N2O3S/c1-10-4-6-12(7-5-10)18(15,16)14-13-9-11-3-2-8-17-11/h2-9,14H,1H3/b13-9+
InChIKey
QHAQHUCZLYGDLT-UKTHLTGXSA-N
Compound name
N-[(E)-furan-2-ylmethylideneamino]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

264.05685 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.06413 157.4
[M+Na]+ 287.04607 166.0
[M-H]- 263.04957 166.9
[M+NH4]+ 282.09067 175.1
[M+K]+ 303.02001 163.7
[M+H-H2O]+ 247.05411 150.6
[M+HCOO]- 309.05505 180.5
[M+CH3COO]- 323.07070 196.7
[M+Na-2H]- 285.03152 163.4
[M]+ 264.05630 161.8
[M]- 264.05740 161.8
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.