CID 9979639

8-hydroxycarvedilol

Structural Information

Molecular Formula
C24H26N2O5
SMILES
COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=C(N3)C(=CC=C4)O)O
InChI
InChI=1S/C24H26N2O5/c1-29-20-9-2-3-10-21(20)30-13-12-25-14-16(27)15-31-22-11-5-7-18-23(22)17-6-4-8-19(28)24(17)26-18/h2-11,16,25-28H,12-15H2,1H3
InChIKey
GPPVNZVFGNMPNR-UHFFFAOYSA-N
Compound name
5-[2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propoxy]-9H-carbazol-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

422.18417 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.19145 202.9
[M+Na]+ 445.17339 215.1
[M+NH4]+ 440.21799 208.7
[M+K]+ 461.14733 209.8
[M-H]- 421.17689 205.9
[M+Na-2H]- 443.15884 207.5
[M]+ 422.18362 205.3
[M]- 422.18472 205.3
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.