CID 3051477

1-(4-indanyloxy)-3-morpholino-2-propanol

Structural Information

Molecular Formula
C16H23NO3
SMILES
C1CC2=C(C1)C(=CC=C2)OCC(CN3CCOCC3)O
InChI
InChI=1S/C16H23NO3/c18-14(11-17-7-9-19-10-8-17)12-20-16-6-2-4-13-3-1-5-15(13)16/h2,4,6,14,18H,1,3,5,7-12H2
InChIKey
TUBWJHMEPHWCGK-UHFFFAOYSA-N
Compound name
1-(2,3-dihydro-1H-inden-4-yloxy)-3-morpholin-4-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1678 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.17508 165.1
[M+Na]+ 300.15702 168.0
[M-H]- 276.16052 168.9
[M+NH4]+ 295.20162 179.7
[M+K]+ 316.13096 166.0
[M+H-H2O]+ 260.16506 157.1
[M+HCOO]- 322.16600 179.4
[M+CH3COO]- 336.18165 195.2
[M+Na-2H]- 298.14247 166.8
[M]+ 277.16725 161.9
[M]- 277.16835 161.9
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.