CID 10045635

4-hydroxycilostazol

Structural Information

Molecular Formula
C20H27N5O3
SMILES
C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4O
InChI
InChI=1S/C20H27N5O3/c26-18-13-20(27)21-17-10-9-15(12-16(17)18)28-11-5-4-8-19-22-23-24-25(19)14-6-2-1-3-7-14/h9-10,12,14,18,26H,1-8,11,13H2,(H,21,27)
InChIKey
FCWDVHXHKQJPQA-UHFFFAOYSA-N
Compound name
6-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-4-hydroxy-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

4
Patents

385.2114 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.21868 195.1
[M+Na]+ 408.20062 198.9
[M-H]- 384.20412 195.1
[M+NH4]+ 403.24522 200.3
[M+K]+ 424.17456 192.0
[M+H-H2O]+ 368.20866 182.5
[M+HCOO]- 430.20960 202.8
[M+CH3COO]- 444.22525 200.3
[M+Na-2H]- 406.18607 193.4
[M]+ 385.21085 189.8
[M]- 385.21195 189.8
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

No patent data available for this compound.