CID 48653

66967-79-1

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.1181 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.12538 136.2
[M+Na]+ 205.10732 144.5
[M-H]- 181.11082 140.9
[M+NH4]+ 200.15192 156.6
[M+K]+ 221.08126 138.1
[M+H-H2O]+ 165.11536 134.0
[M+HCOO]- 227.11630 160.0
[M+CH3COO]- 241.13195 179.0
[M+Na-2H]- 203.09277 146.1
[M]+ 182.11755 137.2
[M]- 182.11865 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.