CID 8026773

4-(propan-2-yl)-n-propylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C12H19NO2S
SMILES
CCCNS(=O)(=O)C1=CC=C(C=C1)C(C)C
InChI
InChI=1S/C12H19NO2S/c1-4-9-13-16(14,15)12-7-5-11(6-8-12)10(2)3/h5-8,10,13H,4,9H2,1-3H3
InChIKey
BLWGWSLJTGXQQU-UHFFFAOYSA-N
Compound name
4-propan-2-yl-N-propylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

241.11365 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.12093 155.5
[M+Na]+ 264.10287 165.7
[M+NH4]+ 259.14747 162.9
[M+K]+ 280.07681 158.3
[M-H]- 240.10637 156.8
[M+Na-2H]- 262.08832 160.5
[M]+ 241.11310 157.7
[M]- 241.11420 157.7
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

patents stripe