CID 120411

Brn 1027155

Structural Information

Molecular Formula
C22H37NO5
SMILES
CC1=CC(=C(C=C1)C(C)C)OCCOCCOCCOCCN2CCOCC2
InChI
InChI=1S/C22H37NO5/c1-19(2)21-5-4-20(3)18-22(21)28-17-16-27-15-14-26-13-12-25-11-8-23-6-9-24-10-7-23/h4-5,18-19H,6-17H2,1-3H3
InChIKey
IPCVMVMCDCHILU-UHFFFAOYSA-N
Compound name
4-[2-[2-[2-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]ethoxy]ethoxy]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.26718 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.27446 199.8
[M+Na]+ 418.25640 209.4
[M+NH4]+ 413.30100 204.9
[M+K]+ 434.23034 202.9
[M-H]- 394.25990 202.8
[M+Na-2H]- 416.24185 202.7
[M]+ 395.26663 201.8
[M]- 395.26773 201.8
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.