CID 30619

(o-hydroxyphenyl)trimethylammonium iodide

Structural Information

Molecular Formula
C9H14NO
SMILES
C[N+](C)(C)C1=CC=CC=C1O
InChI
InChI=1S/C9H13NO/c1-10(2,3)8-6-4-5-7-9(8)11/h4-7H,1-3H3/p+1
InChIKey
VDAMZFHTCKFXBJ-UHFFFAOYSA-O
Compound name
(2-hydroxyphenyl)-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

153
Patents

152.10754 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.11482 128.6
[M+Na]+ 175.09676 136.5
[M-H]- 151.10026 133.1
[M+NH4]+ 170.14136 150.0
[M+K]+ 191.07070 129.8
[M+H-H2O]+ 135.10480 126.6
[M+HCOO]- 197.10574 152.5
[M+CH3COO]- 211.12139 172.9
[M+Na-2H]- 173.08221 139.6
[M]+ 152.10699 127.5
[M]- 152.10809 127.5
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