CID 2750259

101566-05-6

Structural Information

Molecular Formula
C10H9NO3
SMILES
C1C2=C(C=C(C=C2)CC(=O)O)NC1=O
InChI
InChI=1S/C10H9NO3/c12-9-5-7-2-1-6(4-10(13)14)3-8(7)11-9/h1-3H,4-5H2,(H,11,12)(H,13,14)
InChIKey
SLTMYJVEPKGZTR-UHFFFAOYSA-N
Compound name
2-(2-oxo-1,3-dihydroindol-6-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

191.05824 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.06552 138.8
[M+Na]+ 214.04746 147.2
[M-H]- 190.05096 139.6
[M+NH4]+ 209.09206 158.5
[M+K]+ 230.02140 143.6
[M+H-H2O]+ 174.05550 133.3
[M+HCOO]- 236.05644 157.9
[M+CH3COO]- 250.07209 177.2
[M+Na-2H]- 212.03291 142.7
[M]+ 191.05769 137.0
[M]- 191.05879 137.0
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