CID 12245623

3-(methoxymethyl)benzaldehyde

Structural Information

Molecular Formula
C9H10O2
SMILES
COCC1=CC(=CC=C1)C=O
InChI
InChI=1S/C9H10O2/c1-11-7-9-4-2-3-8(5-9)6-10/h2-6H,7H2,1H3
InChIKey
BQWQTLKHBHLJAQ-UHFFFAOYSA-N
Compound name
3-(methoxymethyl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

124
Patents

150.06808 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.07536 129.3
[M+Na]+ 173.05730 142.9
[M+NH4]+ 168.10190 138.3
[M+K]+ 189.03124 136.0
[M-H]- 149.06080 131.7
[M+Na-2H]- 171.04275 137.0
[M]+ 150.06753 131.9
[M]- 150.06863 131.9
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