CID 41215

N-salicyloyl-2-methyl-5-methoxy-3-indolylacetic acid

Structural Information

Molecular Formula
C19H17NO5
SMILES
CC1=C(C2=C(N1C(=O)C3=CC=CC=C3O)C=CC(=C2)OC)CC(=O)O
InChI
InChI=1S/C19H17NO5/c1-11-14(10-18(22)23)15-9-12(25-2)7-8-16(15)20(11)19(24)13-5-3-4-6-17(13)21/h3-9,21H,10H2,1-2H3,(H,22,23)
InChIKey
GRMRQLKCYWGDJZ-UHFFFAOYSA-N
Compound name
2-[1-(2-hydroxybenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.1107 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.11798 178.2
[M+Na]+ 362.09992 191.5
[M+NH4]+ 357.14452 183.9
[M+K]+ 378.07386 188.2
[M-H]- 338.10342 179.7
[M+Na-2H]- 360.08537 183.0
[M]+ 339.11015 180.4
[M]- 339.11125 180.4
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

No patent data available for this compound.