CID 74621

1-hydroxy-2-phenylindole

Structural Information

Molecular Formula
C14H11NO
SMILES
C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2O
InChI
InChI=1S/C14H11NO/c16-15-13-9-5-4-8-12(13)10-14(15)11-6-2-1-3-7-11/h1-10,16H
InChIKey
GSCZNYAHWDLULJ-UHFFFAOYSA-N
Compound name
1-hydroxy-2-phenylindole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

76
Patents

209.08406 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.091336 143.2
[M+Na]+ 232.073278 153.8
[M-H]- 208.076784 149.3
[M+NH4]+ 227.117883 163.1
[M+K]+ 248.047218 148.6
[M+H-H2O]+ 192.081320 136.2
[M+HCOO]- 254.082261 167.2
[M+CH3COO]- 268.097911 157.2
[M+Na-2H]- 230.058726 150.9
[M]+ 209.08351142 144.3
[M]- 209.08460858 144.3
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