CID 170983

51135-38-7

Structural Information

Molecular Formula
C15H11NO2
SMILES
C1C2=C(C(=CC=C2)C(=O)C3=CC=CC=C3)NC1=O
InChI
InChI=1S/C15H11NO2/c17-13-9-11-7-4-8-12(14(11)16-13)15(18)10-5-2-1-3-6-10/h1-8H,9H2,(H,16,17)
InChIKey
APGQYYFHBPQPTL-UHFFFAOYSA-N
Compound name
7-benzoyl-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

29
Patents

237.07898 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.08626 151.8
[M+Na]+ 260.06820 159.9
[M-H]- 236.07170 157.0
[M+NH4]+ 255.11280 169.9
[M+K]+ 276.04214 154.7
[M+H-H2O]+ 220.07624 144.5
[M+HCOO]- 282.07718 172.0
[M+CH3COO]- 296.09283 164.0
[M+Na-2H]- 258.05365 155.7
[M]+ 237.07843 149.6
[M]- 237.07953 149.6
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