CID 15200008

168628-97-5

Structural Information

Molecular Formula
C11H13NO3
SMILES
C1CC(CC2=C1C=CC=C2O)(C(=O)O)N
InChI
InChI=1S/C11H13NO3/c12-11(10(14)15)5-4-7-2-1-3-9(13)8(7)6-11/h1-3,13H,4-6,12H2,(H,14,15)
InChIKey
MIZUUMRXJDZBJU-UHFFFAOYSA-N
Compound name
2-amino-8-hydroxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

207.08954 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 143.7
[M+Na]+ 230.07876 150.7
[M-H]- 206.08226 145.2
[M+NH4]+ 225.12336 163.8
[M+K]+ 246.05270 147.6
[M+H-H2O]+ 190.08680 138.9
[M+HCOO]- 252.08774 161.8
[M+CH3COO]- 266.10339 183.0
[M+Na-2H]- 228.06421 149.1
[M]+ 207.08899 139.1
[M]- 207.09009 139.1
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

patents stripe