CID 110879

1-indanamine, n-(2-morpholinopropionyl)-

Structural Information

Molecular Formula
C16H22N2O2
SMILES
C1CC2=CC=CC=C2C1NC(=O)CCN3CCOCC3
InChI
InChI=1S/C16H22N2O2/c19-16(7-8-18-9-11-20-12-10-18)17-15-6-5-13-3-1-2-4-14(13)15/h1-4,15H,5-12H2,(H,17,19)
InChIKey
WQGMHNCPXFNNDC-UHFFFAOYSA-N
Compound name
N-(2,3-dihydro-1H-inden-1-yl)-3-morpholin-4-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.17540 164.4
[M+Na]+ 297.15734 167.4
[M-H]- 273.16084 169.6
[M+NH4]+ 292.20194 179.6
[M+K]+ 313.13128 164.9
[M+H-H2O]+ 257.16538 156.0
[M+HCOO]- 319.16632 181.3
[M+CH3COO]- 333.18197 199.1
[M+Na-2H]- 295.14279 167.0
[M]+ 274.16757 160.2
[M]- 274.16867 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.