CID 212059

23842-54-8

Structural Information

Molecular Formula
C10H11NO4
SMILES
C1C(C2=C(C=CC(=C2)O)C(N1)C(=O)O)O
InChI
InChI=1S/C10H11NO4/c12-5-1-2-6-7(3-5)8(13)4-11-9(6)10(14)15/h1-3,8-9,11-13H,4H2,(H,14,15)
InChIKey
MEIKIYLBAAEQJC-UHFFFAOYSA-N
Compound name
4,6-dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.0688 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.07608 143.4
[M+Na]+ 232.05802 153.8
[M+NH4]+ 227.10262 149.7
[M+K]+ 248.03196 150.3
[M-H]- 208.06152 142.3
[M+Na-2H]- 230.04347 145.8
[M]+ 209.06825 144.1
[M]- 209.06935 144.1
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.