CID 3060492

78186-46-6

Structural Information

Molecular Formula
C24H35NO5
SMILES
CCN(CC)CC(C)C(C1=CC(=C(C=C1)OC)OC)(C2=CC(=C(C=C2)OC)OC)O
InChI
InChI=1S/C24H35NO5/c1-8-25(9-2)16-17(3)24(26,18-10-12-20(27-4)22(14-18)29-6)19-11-13-21(28-5)23(15-19)30-7/h10-15,17,26H,8-9,16H2,1-7H3
InChIKey
VHMBRXRZSITEPW-UHFFFAOYSA-N
Compound name
3-(diethylamino)-1,1-bis(3,4-dimethoxyphenyl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

417.25153 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 418.25881 204.2
[M+Na]+ 440.24075 208.2
[M-H]- 416.24425 210.3
[M+NH4]+ 435.28535 214.3
[M+K]+ 456.21469 207.3
[M+H-H2O]+ 400.24879 195.0
[M+HCOO]- 462.24973 223.4
[M+CH3COO]- 476.26538 233.9
[M+Na-2H]- 438.22620 203.3
[M]+ 417.25098 213.0
[M]- 417.25208 213.0
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

No patent data available for this compound.