CID 363864

Nsc629153

Structural Information

Molecular Formula
C24H22N2O4
SMILES
COC1=CC(=C(C(=C1)OC)C2=NOC(C2)N3C4=CC=CC=C4C5=CC=CC=C53)OC
InChI
InChI=1S/C24H22N2O4/c1-27-15-12-21(28-2)24(22(13-15)29-3)18-14-23(30-25-18)26-19-10-6-4-8-16(19)17-9-5-7-11-20(17)26/h4-13,23H,14H2,1-3H3
InChIKey
OVYFGWBMKUNVHY-UHFFFAOYSA-N
Compound name
5-carbazol-9-yl-3-(2,4,6-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.15796 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.16524 196.1
[M+Na]+ 425.14718 206.7
[M-H]- 401.15068 207.3
[M+NH4]+ 420.19178 208.6
[M+K]+ 441.12112 202.6
[M+H-H2O]+ 385.15522 186.7
[M+HCOO]- 447.15616 216.2
[M+CH3COO]- 461.17181 207.4
[M+Na-2H]- 423.13263 196.8
[M]+ 402.15741 204.4
[M]- 402.15851 204.4
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.