CID 5468233

Nsc666399

Structural Information

Molecular Formula
C21H18N2O2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C21H18N2O2S/c1-15-10-12-16(13-11-15)26(24,25)23-22-14-21-19-8-4-2-6-17(19)18-7-3-5-9-20(18)21/h2-14,21,23H,1H3/b22-14+
InChIKey
QKOKUNYPPZUDQR-HYARGMPZSA-N
Compound name
N-[(E)-9H-fluoren-9-ylmethylideneamino]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.1089 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.11618 184.0
[M+Na]+ 385.09812 193.1
[M-H]- 361.10162 194.1
[M+NH4]+ 380.14272 201.1
[M+K]+ 401.07206 186.8
[M+H-H2O]+ 345.10616 176.5
[M+HCOO]- 407.10710 204.3
[M+CH3COO]- 421.12275 195.6
[M+Na-2H]- 383.08357 190.1
[M]+ 362.10835 188.2
[M]- 362.10945 188.2
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.