CID 15914

Phenyltrimethylammonium

Structural Information

Molecular Formula

C₉H₁₄N

SMILES

C[N+](C)(C)C1=CC=CC=C1

InChI

InChI=1S/C9H14N/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3/q+1

InChIKey

ZNEOHLHCKGUAEB-UHFFFAOYSA-N

Compound name

trimethyl(phenyl)azanium

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 124
References: 23220
Patents: 136.11263 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	137.11991	125.9
[M+Na]+	159.10185	141.3
[M+NH4]+	154.14645	137.4
[M+K]+	175.07579	134.8
[M-H]-	135.10535	131.6
[M+Na-2H]-	157.08730	136.4
[M]+	136.11208	130.3
[M]-	136.11318	130.3

Literature stripe

literature stripe

Patent stripe

patents stripe