CID 108319

55203-60-6

Structural Information

Molecular Formula
C17H20N2O2S
SMILES
CC(C)C(=NNC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2)C
InChI
InChI=1S/C17H20N2O2S/c1-13(2)14(3)18-19-15-9-11-17(12-10-15)22(20,21)16-7-5-4-6-8-16/h4-13,19H,1-3H3
InChIKey
YNWHKQATCFUTIK-UHFFFAOYSA-N
Compound name
4-(benzenesulfonyl)-N-(3-methylbutan-2-ylideneamino)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.12454 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.13182 173.3
[M+Na]+ 339.11376 184.4
[M+NH4]+ 334.15836 180.5
[M+K]+ 355.08770 176.3
[M-H]- 315.11726 177.6
[M+Na-2H]- 337.09921 181.4
[M]+ 316.12399 176.5
[M]- 316.12509 176.5
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.