CID 3053283

Brn 0432539

Structural Information

Molecular Formula
C20H26N2O2
SMILES
CN(CCC1=CC=CC=N1)CC(COC2=CC3=C(CCC3)C=C2)O
InChI
InChI=1S/C20H26N2O2/c1-22(12-10-18-7-2-3-11-21-18)14-19(23)15-24-20-9-8-16-5-4-6-17(16)13-20/h2-3,7-9,11,13,19,23H,4-6,10,12,14-15H2,1H3
InChIKey
CMPORSWCTBOSJC-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1H-inden-5-yloxy)-3-[methyl(2-pyridin-2-ylethyl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.19943 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.20671 180.3
[M+Na]+ 349.18865 191.2
[M+NH4]+ 344.23325 188.1
[M+K]+ 365.16259 185.6
[M-H]- 325.19215 184.3
[M+Na-2H]- 347.17410 186.5
[M]+ 326.19888 182.8
[M]- 326.19998 182.8
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.