CID 23814

7355-60-4

Structural Information

Molecular Formula
C11H14NO2
SMILES
CC1CC2=CC(=C(C=C2C=[N+]1C)O)O
InChI
InChI=1S/C11H13NO2/c1-7-3-8-4-10(13)11(14)5-9(8)6-12(7)2/h4-7,14H,3H2,1-2H3/p+1
InChIKey
KQOMFUNHSRFDAV-UHFFFAOYSA-O
Compound name
2,3-dimethyl-3,4-dihydroisoquinolin-2-ium-6,7-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.10245 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10973 138.2
[M+Na]+ 215.09167 154.3
[M+NH4]+ 210.13627 148.0
[M+K]+ 231.06561 148.6
[M-H]- 191.09517 141.8
[M+Na-2H]- 213.07712 144.9
[M]+ 192.10190 141.9
[M]- 192.10300 141.9
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.