CID 11064226

374067-96-6

Structural Information

Molecular Formula
C10H15NO3S
SMILES
CC(C)(CO)C1=CC=C(C=C1)S(=O)(=O)N
InChI
InChI=1S/C10H15NO3S/c1-10(2,7-12)8-3-5-9(6-4-8)15(11,13)14/h3-6,12H,7H2,1-2H3,(H2,11,13,14)
InChIKey
SOOTXJBKDRWYBZ-UHFFFAOYSA-N
Compound name
4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

229.07727 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.084546 149.4
[M+Na]+ 252.066488 156.9
[M-H]- 228.069994 151.4
[M+NH4]+ 247.111093 166.7
[M+K]+ 268.040428 153.4
[M+H-H2O]+ 212.074530 144.0
[M+HCOO]- 274.075471 164.9
[M+CH3COO]- 288.091121 186.3
[M+Na-2H]- 250.051936 153.7
[M]+ 229.07672142 150.2
[M]- 229.07781858 150.2
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