CID 115025061

1890542-71-8

Structural Information

Molecular Formula
C11H13NO3
SMILES
COC(=O)C1CC2=C(C1N)C=CC=C2O
InChI
InChI=1S/C11H13NO3/c1-15-11(14)8-5-7-6(10(8)12)3-2-4-9(7)13/h2-4,8,10,13H,5,12H2,1H3
InChIKey
BQKDKMPLZYAUKR-UHFFFAOYSA-N
Compound name
methyl 1-amino-4-hydroxy-2,3-dihydro-1H-indene-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.08954 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 143.8
[M+Na]+ 230.07876 153.7
[M+NH4]+ 225.12336 151.6
[M+K]+ 246.05270 151.0
[M-H]- 206.08226 144.9
[M+Na-2H]- 228.06421 146.9
[M]+ 207.08899 145.2
[M]- 207.09009 145.2
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.