CID 3042220

Brn 1262415

Structural Information

Molecular Formula
C19H24N2O3
SMILES
CCC1(C(=O)C2=CC=CC=C2C1=O)N(C)C(=O)CN3CCCCC3
InChI
InChI=1S/C19H24N2O3/c1-3-19(17(23)14-9-5-6-10-15(14)18(19)24)20(2)16(22)13-21-11-7-4-8-12-21/h5-6,9-10H,3-4,7-8,11-13H2,1-2H3
InChIKey
GQQACVABDQXPCN-UHFFFAOYSA-N
Compound name
N-(2-ethyl-1,3-dioxoinden-2-yl)-N-methyl-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.17868 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.18596 178.0
[M+Na]+ 351.16790 182.9
[M-H]- 327.17140 184.6
[M+NH4]+ 346.21250 195.3
[M+K]+ 367.14184 180.0
[M+H-H2O]+ 311.17594 170.0
[M+HCOO]- 373.17688 195.8
[M+CH3COO]- 387.19253 213.8
[M+Na-2H]- 349.15335 177.7
[M]+ 328.17813 176.6
[M]- 328.17923 176.6
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.