CID 28302928

3077-64-3

Structural Information

Molecular Formula
C10H15NO3S
SMILES
CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)O
InChI
InChI=1S/C10H15NO3S/c1-10(2,3)11-15(13,14)9-6-4-8(12)5-7-9/h4-7,11-12H,1-3H3
InChIKey
AOCCGMAXRARECN-UHFFFAOYSA-N
Compound name
N-tert-butyl-4-hydroxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

229.07727 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.08455 149.1
[M+Na]+ 252.06649 156.7
[M-H]- 228.06999 151.8
[M+NH4]+ 247.11109 166.9
[M+K]+ 268.04043 153.7
[M+H-H2O]+ 212.07453 143.8
[M+HCOO]- 274.07547 165.4
[M+CH3COO]- 288.09112 186.2
[M+Na-2H]- 250.05194 154.5
[M]+ 229.07672 151.0
[M]- 229.07782 151.0
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