CID 2440007

6-(morpholine-4-sulfonyl)-1h-1,2,3-benzotriazol-1-ol

Structural Information

Molecular Formula
C10H12N4O4S
SMILES
C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=NN3O
InChI
InChI=1S/C10H12N4O4S/c15-14-10-7-8(1-2-9(10)11-12-14)19(16,17)13-3-5-18-6-4-13/h1-2,7,15H,3-6H2
InChIKey
DRTKWKYMHRDNTH-UHFFFAOYSA-N
Compound name
4-(3-hydroxybenzotriazol-5-yl)sulfonylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

284.05792 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.06520 159.9
[M+Na]+ 307.04714 170.1
[M-H]- 283.05064 162.3
[M+NH4]+ 302.09174 171.6
[M+K]+ 323.02108 167.3
[M+H-H2O]+ 267.05518 152.4
[M+HCOO]- 329.05612 170.6
[M+CH3COO]- 343.07177 170.8
[M+Na-2H]- 305.03259 164.9
[M]+ 284.05737 162.0
[M]- 284.05847 162.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.