CID 7147155

6-amino-n-tert-butylpyridine-3-sulfonamide

Structural Information

Molecular Formula
C9H15N3O2S
SMILES
CC(C)(C)NS(=O)(=O)C1=CN=C(C=C1)N
InChI
InChI=1S/C9H15N3O2S/c1-9(2,3)12-15(13,14)7-4-5-8(10)11-6-7/h4-6,12H,1-3H3,(H2,10,11)
InChIKey
HPDHKHFOADQBPP-UHFFFAOYSA-N
Compound name
6-amino-N-tert-butylpyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

229.0885 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.095776 150.2
[M+Na]+ 252.077718 158.0
[M-H]- 228.081224 152.4
[M+NH4]+ 247.122323 166.7
[M+K]+ 268.051658 154.8
[M+H-H2O]+ 212.085760 143.7
[M+HCOO]- 274.086701 167.1
[M+CH3COO]- 288.102351 190.7
[M+Na-2H]- 250.063166 155.8
[M]+ 229.08795142 150.7
[M]- 229.08904858 150.7
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