CID 61586

4-(ethoxymethyl)-2-methoxyphenol

Structural Information

Molecular Formula
C10H14O3
SMILES
CCOCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C10H14O3/c1-3-13-7-8-4-5-9(11)10(6-8)12-2/h4-6,11H,3,7H2,1-2H3
InChIKey
KOCVACNWDMSLBM-UHFFFAOYSA-N
Compound name
4-(ethoxymethyl)-2-methoxyphenol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1
References

5312
Patents

182.0943 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.10158 137.5
[M+Na]+ 205.08352 145.8
[M-H]- 181.08702 140.2
[M+NH4]+ 200.12812 157.3
[M+K]+ 221.05746 144.4
[M+H-H2O]+ 165.09156 132.0
[M+HCOO]- 227.09250 160.9
[M+CH3COO]- 241.10815 180.0
[M+Na-2H]- 203.06897 143.3
[M]+ 182.09375 141.0
[M]- 182.09485 141.0
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