CID 18986923

669775-43-3

Structural Information

Molecular Formula
C23H33NO3
SMILES
CCCN(CCC)CCC1=CC(=C(C=C1)OC)OCCC2=CC=C(C=C2)O
InChI
InChI=1S/C23H33NO3/c1-4-14-24(15-5-2)16-12-20-8-11-22(26-3)23(18-20)27-17-13-19-6-9-21(25)10-7-19/h6-11,18,25H,4-5,12-17H2,1-3H3
InChIKey
XGMGOPZOOJNJPJ-UHFFFAOYSA-N
Compound name
4-[2-[5-[2-(dipropylamino)ethyl]-2-methoxyphenoxy]ethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

371.24603 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.25331 195.1
[M+Na]+ 394.23525 207.2
[M+NH4]+ 389.27985 201.8
[M+K]+ 410.20919 198.6
[M-H]- 370.23875 199.6
[M+Na-2H]- 392.22070 201.7
[M]+ 371.24548 198.1
[M]- 371.24658 198.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe