CID 67211

129-41-9

Structural Information

Molecular Formula
C17H13Cl2NO3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC3=C2C(=CC(=C3O)Cl)Cl
InChI
InChI=1S/C17H13Cl2NO3S/c1-10-5-7-11(8-6-10)24(22,23)20-15-4-2-3-12-16(15)13(18)9-14(19)17(12)21/h2-9,20-21H,1H3
InChIKey
VIWFMROFBWHDBY-UHFFFAOYSA-N
Compound name
N-(6,8-dichloro-5-hydroxynaphthalen-1-yl)-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

380.99933 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.00661 184.6
[M+Na]+ 403.98855 200.8
[M+NH4]+ 399.03315 193.2
[M+K]+ 419.96249 190.2
[M-H]- 379.99205 189.2
[M+Na-2H]- 401.97400 192.5
[M]+ 380.99878 189.5
[M]- 380.99988 189.5
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