CID 3067110

80843-55-6

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

362.1882 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.195476 190.3
[M+Na]+ 385.177418 195.7
[M-H]- 361.180924 199.3
[M+NH4]+ 380.222023 202.2
[M+K]+ 401.151358 191.4
[M+H-H2O]+ 345.185460 180.3
[M+HCOO]- 407.186401 211.4
[M+CH3COO]- 421.202051 216.5
[M+Na-2H]- 383.162866 194.6
[M]+ 362.18765142 194.4
[M]- 362.18874858 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