CID 137580

4-methoxyphenyl

Structural Information

Molecular Formula
C7H7O
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
2
Annotation Hits

0
References

1
Patents

107.04969 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.05697 117.2
[M+Na]+ 130.03891 125.5
[M-H]- 106.04241 121.2
[M+NH4]+ 125.08351 140.3
[M+K]+ 146.01285 124.8
[M+H-H2O]+ 90.046950 112.2
[M+HCOO]- 152.04789 142.8
[M+CH3COO]- 166.06354 167.4
[M+Na-2H]- 128.02436 126.8
[M]+ 107.04914 117.9
[M]- 107.05024 117.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe