CID 137580

4-methoxyphenyl

Structural Information

Molecular Formula

SMILES

COC1=CC=[C]C=C1

InChI

InChI=1S/C7H7O/c1-8-7-5-3-2-4-6-7/h3-6H,1H3

InChIKey

GPKUICFDWYEPTK-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 107.04969 Da
Monoisotopic Mass: 2.1
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]+	108.05697	118.1
[M+Na]+	130.03891	132.1
[M+NH4]+	125.08351	128.2
[M+K]+	146.01285	125.0
[M-H]-	106.04241	121.2
[M+Na-2H]-	128.02436	127.2
[M]+	107.04914	121.0
[M]-	107.05024	121.0

Literature stripe

literature stripe

Patent stripe

patents stripe