CID 18438746

5-(benzyloxy)indolin-2-one

Structural Information

Molecular Formula
C15H13NO2
SMILES
C1C2=C(C=CC(=C2)OCC3=CC=CC=C3)NC1=O
InChI
InChI=1S/C15H13NO2/c17-15-9-12-8-13(6-7-14(12)16-15)18-10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,16,17)
InChIKey
YQNYTVVGWCZWLL-UHFFFAOYSA-N
Compound name
5-phenylmethoxy-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

239.09464 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.10192 152.4
[M+Na]+ 262.08386 160.5
[M-H]- 238.08736 157.4
[M+NH4]+ 257.12846 170.6
[M+K]+ 278.05780 155.5
[M+H-H2O]+ 222.09190 144.9
[M+HCOO]- 284.09284 173.5
[M+CH3COO]- 298.10849 164.7
[M+Na-2H]- 260.06931 157.5
[M]+ 239.09409 151.5
[M]- 239.09519 151.5
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