CID 30663

21489-79-2

Structural Information

Molecular Formula
C12H13NO2
SMILES
CN(C)C1=CC2=C(C=C1)C(=C(C=C2)O)O
InChI
InChI=1S/C12H13NO2/c1-13(2)9-4-5-10-8(7-9)3-6-11(14)12(10)15/h3-7,14-15H,1-2H3
InChIKey
HOHKPEWOIFVYBX-UHFFFAOYSA-N
Compound name
6-(dimethylamino)naphthalene-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.09464 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.101916 142.1
[M+Na]+ 226.083858 150.8
[M-H]- 202.087364 146.1
[M+NH4]+ 221.128463 161.9
[M+K]+ 242.057798 148.1
[M+H-H2O]+ 186.091900 136.3
[M+HCOO]- 248.092841 164.5
[M+CH3COO]- 262.108491 188.6
[M+Na-2H]- 224.069306 148.6
[M]+ 203.09409142 142.7
[M]- 203.09518858 142.7
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.