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]+ 262.15502 160.7
[M+Na]+ 284.13696 164.6
[M-H]- 260.14046 166.1
[M+NH4]+ 279.18156 179.7
[M+K]+ 300.11090 163.5
[M+H-H2O]+ 244.14500 153.5
[M+HCOO]- 306.14594 185.1
[M+CH3COO]- 320.16159 205.8
[M+Na-2H]- 282.12241 163.5
[M]+ 261.14719 159.9
[M]- 261.14829 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