CID 2887736

1-carbazol-9-yl-3-(3,4-dimethylphenoxy)propan-2-ol

Structural Information

Molecular Formula
C23H23NO2
SMILES
CC1=C(C=C(C=C1)OCC(CN2C3=CC=CC=C3C4=CC=CC=C42)O)C
InChI
InChI=1S/C23H23NO2/c1-16-11-12-19(13-17(16)2)26-15-18(25)14-24-22-9-5-3-7-20(22)21-8-4-6-10-23(21)24/h3-13,18,25H,14-15H2,1-2H3
InChIKey
IYVRPHFVFYPMIM-UHFFFAOYSA-N
Compound name
1-carbazol-9-yl-3-(3,4-dimethylphenoxy)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.17288 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.18016 185.0
[M+Na]+ 368.16210 193.8
[M-H]- 344.16560 191.4
[M+NH4]+ 363.20670 200.2
[M+K]+ 384.13604 187.2
[M+H-H2O]+ 328.17014 176.2
[M+HCOO]- 390.17108 204.3
[M+CH3COO]- 404.18673 195.6
[M+Na-2H]- 366.14755 187.7
[M]+ 345.17233 189.0
[M]- 345.17343 189.0
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.