CID 384306

Nsc673922

Structural Information

Molecular Formula
C19H30N2O2S
SMILES
CC1CC(CC(C1=NNS(=O)(=O)C2=CC=C(C=C2)C)C)C(C)(C)C
InChI
InChI=1S/C19H30N2O2S/c1-13-7-9-17(10-8-13)24(22,23)21-20-18-14(2)11-16(12-15(18)3)19(4,5)6/h7-10,14-16,21H,11-12H2,1-6H3
InChIKey
FGSJBNDKHPRTBI-UHFFFAOYSA-N
Compound name
N-[(4-tert-butyl-2,6-dimethylcyclohexylidene)amino]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2028 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.21008 183.6
[M+Na]+ 373.19202 188.7
[M-H]- 349.19552 190.9
[M+NH4]+ 368.23662 197.7
[M+K]+ 389.16596 184.6
[M+H-H2O]+ 333.20006 176.1
[M+HCOO]- 395.20100 198.0
[M+CH3COO]- 409.21665 220.2
[M+Na-2H]- 371.17747 184.3
[M]+ 350.20225 183.9
[M]- 350.20335 183.9
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.