CID 75051323

6-hydroxygliclazide

Structural Information

Molecular Formula
C15H21N3O4S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN2CC3CCC(C3C2)O
InChI
InChI=1S/C15H21N3O4S/c1-10-2-5-12(6-3-10)23(21,22)17-15(20)16-18-8-11-4-7-14(19)13(11)9-18/h2-3,5-6,11,13-14,19H,4,7-9H2,1H3,(H2,16,17,20)
InChIKey
VUUZEWXIRFGRFE-UHFFFAOYSA-N
Compound name
1-(4-hydroxy-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-(4-methylphenyl)sulfonylurea
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

2
Patents

339.12527 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.132546 176.6
[M+Na]+ 362.114488 182.0
[M-H]- 338.117994 181.6
[M+NH4]+ 357.159093 192.6
[M+K]+ 378.088428 178.7
[M+H-H2O]+ 322.122530 171.1
[M+HCOO]- 384.123471 190.7
[M+CH3COO]- 398.139121 207.4
[M+Na-2H]- 360.099936 176.7
[M]+ 339.12472142 175.9
[M]- 339.12581858 175.9
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

patents stripe