CID 115650

63992-25-6

Structural Information

Molecular Formula
C22H28N2O
SMILES
CCN(CC)CCC(=O)NC1C(CC2=CC=CC=C12)C3=CC=CC=C3
InChI
InChI=1S/C22H28N2O/c1-3-24(4-2)15-14-21(25)23-22-19-13-9-8-12-18(19)16-20(22)17-10-6-5-7-11-17/h5-13,20,22H,3-4,14-16H2,1-2H3,(H,23,25)
InChIKey
HKRNFAMJVZSNIT-UHFFFAOYSA-N
Compound name
3-(diethylamino)-N-(2-phenyl-2,3-dihydro-1H-inden-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.22015 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.22743 184.6
[M+Na]+ 359.20937 188.0
[M-H]- 335.21287 192.4
[M+NH4]+ 354.25397 200.7
[M+K]+ 375.18331 183.7
[M+H-H2O]+ 319.21741 175.8
[M+HCOO]- 381.21835 207.2
[M+CH3COO]- 395.23400 220.6
[M+Na-2H]- 357.19482 185.3
[M]+ 336.21960 185.1
[M]- 336.22070 185.1
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.