CID 73689

P-(methoxymethyl)anisole

Structural Information

Molecular Formula
C9H12O2
SMILES
COCC1=CC=C(C=C1)OC
InChI
InChI=1S/C9H12O2/c1-10-7-8-3-5-9(11-2)6-4-8/h3-6H,7H2,1-2H3
InChIKey
RSOYRXBYZFBWFS-UHFFFAOYSA-N
Compound name
1-methoxy-4-(methoxymethyl)benzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

4696
Patents

152.08372 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.09100 129.5
[M+Na]+ 175.07294 137.9
[M-H]- 151.07644 133.5
[M+NH4]+ 170.11754 151.1
[M+K]+ 191.04688 137.2
[M+H-H2O]+ 135.08098 124.0
[M+HCOO]- 197.08192 154.7
[M+CH3COO]- 211.09757 176.5
[M+Na-2H]- 173.05839 137.2
[M]+ 152.08317 132.8
[M]- 152.08427 132.8
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