CID 48655

66967-80-4

Structural Information

Molecular Formula
C10H16NO2
SMILES
C[N+](C)(C)C1=CC(=CC(=C1)OC)O
InChI
InChI=1S/C10H15NO2/c1-11(2,3)8-5-9(12)7-10(6-8)13-4/h5-7H,1-4H3/p+1
InChIKey
JBLZYPJQGKFOEM-UHFFFAOYSA-O
Compound name
(3-hydroxy-5-methoxyphenyl)-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1181 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.125376 136.2
[M+Na]+ 205.107318 144.5
[M-H]- 181.110824 140.9
[M+NH4]+ 200.151923 156.6
[M+K]+ 221.081258 138.1
[M+H-H2O]+ 165.115360 134.0
[M+HCOO]- 227.116301 160.0
[M+CH3COO]- 241.131951 179.0
[M+Na-2H]- 203.092766 146.1
[M]+ 182.11755142 137.2
[M]- 182.11864858 137.2
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.