CID 120452

Brn 0999562

Structural Information

Molecular Formula
C18H29NO3
SMILES
CC1=CC(=C(C=C1)C(C)C)OCCOCCN2CCOCC2
InChI
InChI=1S/C18H29NO3/c1-15(2)17-5-4-16(3)14-18(17)22-13-12-21-11-8-19-6-9-20-10-7-19/h4-5,14-15H,6-13H2,1-3H3
InChIKey
JQQBZBAYWLIOAH-UHFFFAOYSA-N
Compound name
4-[2-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.21475 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.22203 176.4
[M+Na]+ 330.20397 187.9
[M+NH4]+ 325.24857 183.5
[M+K]+ 346.17791 181.2
[M-H]- 306.20747 180.7
[M+Na-2H]- 328.18942 181.3
[M]+ 307.21420 179.2
[M]- 307.21530 179.2
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.