CID 3067120

80843-65-8

Structural Information

Molecular Formula
C24H26O3
SMILES
CC(C)(COCC1=CC(=CC=C1)OC2=CC=C(C=C2)OC)C3=CC=CC=C3
InChI
InChI=1S/C24H26O3/c1-24(2,20-9-5-4-6-10-20)18-26-17-19-8-7-11-23(16-19)27-22-14-12-21(25-3)13-15-22/h4-16H,17-18H2,1-3H3
InChIKey
YEMDMPPNPIJJOF-UHFFFAOYSA-N
Compound name
1-methoxy-4-[3-[(2-methyl-2-phenylpropoxy)methyl]phenoxy]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

362.1882 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.19548 190.3
[M+Na]+ 385.17742 195.7
[M-H]- 361.18092 199.3
[M+NH4]+ 380.22202 202.2
[M+K]+ 401.15136 191.4
[M+H-H2O]+ 345.18546 180.3
[M+HCOO]- 407.18640 211.4
[M+CH3COO]- 421.20205 216.5
[M+Na-2H]- 383.16287 194.6
[M]+ 362.18765 194.4
[M]- 362.18875 194.4
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