CID 10039698

Hyellazole

Structural Information

Molecular Formula
C20H17NO
SMILES
CC1=C(C=C2C3=CC=CC=C3NC2=C1C4=CC=CC=C4)OC
InChI
InChI=1S/C20H17NO/c1-13-18(22-2)12-16-15-10-6-7-11-17(15)21-20(16)19(13)14-8-4-3-5-9-14/h3-12,21H,1-2H3
InChIKey
WMOYBLZINTVESP-UHFFFAOYSA-N
Compound name
3-methoxy-2-methyl-1-phenyl-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

10
Patents

287.131 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.13828 167.4
[M+Na]+ 310.12022 178.3
[M-H]- 286.12372 174.3
[M+NH4]+ 305.16482 185.3
[M+K]+ 326.09416 171.1
[M+H-H2O]+ 270.12826 159.3
[M+HCOO]- 332.12920 188.8
[M+CH3COO]- 346.14485 179.8
[M+Na-2H]- 308.10567 172.9
[M]+ 287.13045 169.8
[M]- 287.13155 169.8
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