CID 5391774

123408-99-1

Structural Information

Molecular Formula
C17H24N2O2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N/N=C\2/C[C@@H]3CC[C@]2(C3(C)C)C
InChI
InChI=1S/C17H24N2O2S/c1-12-5-7-14(8-6-12)22(20,21)19-18-15-11-13-9-10-17(15,4)16(13,2)3/h5-8,13,19H,9-11H2,1-4H3/b18-15-/t13-,17+/m0/s1
InChIKey
DPXSCASCDWIKEX-TZZOIZJYSA-N
Compound name
4-methyl-N-[(Z)-[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]amino]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.15585 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.16313 173.4
[M+Na]+ 343.14507 181.0
[M+NH4]+ 338.18967 184.2
[M+K]+ 359.11901 173.0
[M-H]- 319.14857 175.7
[M+Na-2H]- 341.13052 179.4
[M]+ 320.15530 175.7
[M]- 320.15640 175.7
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.