CID 110888

Brn 2869657

Structural Information

Molecular Formula
C14H19N3O2
SMILES
CN(C)CC(=O)NC(=O)NC1CCC2=CC=CC=C12
InChI
InChI=1S/C14H19N3O2/c1-17(2)9-13(18)16-14(19)15-12-8-7-10-5-3-4-6-11(10)12/h3-6,12H,7-9H2,1-2H3,(H2,15,16,18,19)
InChIKey
CGZDFCPXIJTOJK-UHFFFAOYSA-N
Compound name
N-(2,3-dihydro-1H-inden-1-ylcarbamoyl)-2-(dimethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

261.14774 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.155016 160.7
[M+Na]+ 284.136958 164.6
[M-H]- 260.140464 166.1
[M+NH4]+ 279.181563 179.7
[M+K]+ 300.110898 163.5
[M+H-H2O]+ 244.145000 153.5
[M+HCOO]- 306.145941 185.1
[M+CH3COO]- 320.161591 205.8
[M+Na-2H]- 282.122406 163.5
[M]+ 261.14719142 159.9
[M]- 261.14828858 159.9
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

patents stripe