CID 3054412

4-ethyl-2-((1h-inden-4(or 7)-yloxy)methyl)morpholine

Structural Information

Molecular Formula
C16H21NO2
SMILES
CCN1CCOC(C1)COC2=CC=CC3=C2C=CC3
InChI
InChI=1S/C16H21NO2/c1-2-17-9-10-18-14(11-17)12-19-16-8-4-6-13-5-3-7-15(13)16/h3-4,6-8,14H,2,5,9-12H2,1H3
InChIKey
FAYMYDCYXRHFRJ-UHFFFAOYSA-N
Compound name
4-ethyl-2-(1H-inden-4-yloxymethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.15723 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.164506 160.5
[M+Na]+ 282.146448 166.4
[M-H]- 258.149954 166.5
[M+NH4]+ 277.191053 177.3
[M+K]+ 298.120388 163.9
[M+H-H2O]+ 242.154490 152.5
[M+HCOO]- 304.155431 178.7
[M+CH3COO]- 318.171081 171.9
[M+Na-2H]- 280.131896 164.0
[M]+ 259.15668142 160.2
[M]- 259.15777858 160.2
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.