CID 384290

Nsc673907

Structural Information

Molecular Formula
C17H22N2O2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NN=C2CC3CC4CCC2C4C3
InChI
InChI=1S/C17H22N2O2S/c1-11-2-5-14(6-3-11)22(20,21)19-18-17-10-12-8-13-4-7-15(17)16(13)9-12/h2-3,5-6,12-13,15-16,19H,4,7-10H2,1H3
InChIKey
PGJMKEPVTRHIJD-UHFFFAOYSA-N
Compound name
4-methyl-N-(3-tricyclo[5.2.1.04,8]decanylideneamino)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.1402 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.147476 172.5
[M+Na]+ 341.129418 178.4
[M-H]- 317.132924 179.4
[M+NH4]+ 336.174023 194.0
[M+K]+ 357.103358 174.4
[M+H-H2O]+ 301.137460 167.7
[M+HCOO]- 363.138401 187.6
[M+CH3COO]- 377.154051 183.4
[M+Na-2H]- 339.114866 175.2
[M]+ 318.13965142 173.5
[M]- 318.14074858 173.5
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

No patent data available for this compound.