CID 3062672

3-(o-hydroxybenzoyl)indole

Structural Information

Molecular Formula
C15H11NO2
SMILES
C1=CC=C2C(=C1)C(=CN2)C(=O)C3=CC=CC=C3O
InChI
InChI=1S/C15H11NO2/c17-14-8-4-2-6-11(14)15(18)12-9-16-13-7-3-1-5-10(12)13/h1-9,16-17H
InChIKey
IQWSCRZNQHHOCS-UHFFFAOYSA-N
Compound name
(2-hydroxyphenyl)-(1H-indol-3-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

237.07898 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.08626 150.9
[M+Na]+ 260.06820 160.3
[M-H]- 236.07170 155.5
[M+NH4]+ 255.11280 168.6
[M+K]+ 276.04214 154.5
[M+H-H2O]+ 220.07624 143.9
[M+HCOO]- 282.07718 172.3
[M+CH3COO]- 296.09283 163.5
[M+Na-2H]- 258.05365 156.3
[M]+ 237.07843 150.5
[M]- 237.07953 150.5
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

patents stripe