CID 214043

27588-46-1

Structural Information

Molecular Formula
C23H32N2O3
SMILES
COC1=CC=C(C=C1)C(CCN2CCN(CC2)CC(C3=CC=CC=C3)OC)O
InChI
InChI=1S/C23H32N2O3/c1-27-21-10-8-19(9-11-21)22(26)12-13-24-14-16-25(17-15-24)18-23(28-2)20-6-4-3-5-7-20/h3-11,22-23,26H,12-18H2,1-2H3
InChIKey
ROAVLUMRRORJIL-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-3-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.2413 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.24858 197.1
[M+Na]+ 407.23052 208.9
[M+NH4]+ 402.27512 203.2
[M+K]+ 423.20446 201.7
[M-H]- 383.23402 201.2
[M+Na-2H]- 405.21597 203.9
[M]+ 384.24075 199.8
[M]- 384.24185 199.8
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.