CID 110874

72336-00-6

Structural Information

Molecular Formula
C15H22N2O
SMILES
CCN(CC)CC(=O)NC1CCC2=CC=CC=C12
InChI
InChI=1S/C15H22N2O/c1-3-17(4-2)11-15(18)16-14-10-9-12-7-5-6-8-13(12)14/h5-8,14H,3-4,9-11H2,1-2H3,(H,16,18)
InChIKey
WNBMGEXKKSPUBS-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(2,3-dihydro-1H-inden-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

246.17322 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.180496 159.9
[M+Na]+ 269.162438 164.2
[M-H]- 245.165944 164.9
[M+NH4]+ 264.207043 180.0
[M+K]+ 285.136378 162.2
[M+H-H2O]+ 229.170480 152.8
[M+HCOO]- 291.171421 183.5
[M+CH3COO]- 305.187071 202.8
[M+Na-2H]- 267.147886 162.6
[M]+ 246.17267142 160.1
[M]- 246.17376858 160.1
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.