CID 3069954

85564-85-8

Structural Information

Molecular Formula
C18H24N2O2
SMILES
C1CC2=CC3=C(CCC3)C(=C2C1)NC(=O)CN4CCOCC4
InChI
InChI=1S/C18H24N2O2/c21-17(12-20-7-9-22-10-8-20)19-18-15-5-1-3-13(15)11-14-4-2-6-16(14)18/h11H,1-10,12H2,(H,19,21)
InChIKey
AAEOOQKLYOAAFU-UHFFFAOYSA-N
Compound name
N-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-2-morpholin-4-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.18378 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.19106 172.2
[M+Na]+ 323.17300 181.0
[M+NH4]+ 318.21760 180.9
[M+K]+ 339.14694 178.3
[M-H]- 299.17650 177.1
[M+Na-2H]- 321.15845 174.4
[M]+ 300.18323 174.5
[M]- 300.18433 174.5
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.