CID 6380500

2-(4-chloro-benzenesulfonyl)-2-(p-tolyl-hydrazono)-acetic acid hydrazide

Structural Information

Molecular Formula
C15H15ClN4O3S
SMILES
CC1=CC=C(C=C1)N/N=C(\C(=O)NN)/S(=O)(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H15ClN4O3S/c1-10-2-6-12(7-3-10)19-20-15(14(21)18-17)24(22,23)13-8-4-11(16)5-9-13/h2-9,19H,17H2,1H3,(H,18,21)/b20-15+
InChIKey
JYFQIEBTXJGRBQ-HMMYKYKNSA-N
Compound name
(2E)-2-(4-chlorophenyl)sulfonyl-2-[(4-methylphenyl)hydrazinylidene]acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.05533 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.06261 182.1
[M+Na]+ 389.04455 188.3
[M-H]- 365.04805 189.7
[M+NH4]+ 384.08915 194.7
[M+K]+ 405.01849 183.0
[M+H-H2O]+ 349.05259 174.5
[M+HCOO]- 411.05353 198.8
[M+CH3COO]- 425.06918 219.6
[M+Na-2H]- 387.03000 185.4
[M]+ 366.05478 184.0
[M]- 366.05588 184.0
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.