CID 3058668

75463-42-2

Structural Information

Molecular Formula
C19H26N2O
SMILES
C1CCN(CC1)CC(=O)NC2CCC3=C2C=C4CCCC4=C3
InChI
InChI=1S/C19H26N2O/c22-19(13-21-9-2-1-3-10-21)20-18-8-7-16-11-14-5-4-6-15(14)12-17(16)18/h11-12,18H,1-10,13H2,(H,20,22)
InChIKey
KJYHTMYAKRIPLQ-UHFFFAOYSA-N
Compound name
N-(1,2,3,5,6,7-hexahydro-s-indacen-1-yl)-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

17
Patents

298.2045 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.21178 173.7
[M+Na]+ 321.19372 182.3
[M+NH4]+ 316.23832 182.9
[M+K]+ 337.16766 178.5
[M-H]- 297.19722 177.7
[M+Na-2H]- 319.17917 176.6
[M]+ 298.20395 175.7
[M]- 298.20505 175.7
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

patents stripe