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]+ 337.227426 184.6
[M+Na]+ 359.209368 188.0
[M-H]- 335.212874 192.4
[M+NH4]+ 354.253973 200.7
[M+K]+ 375.183308 183.7
[M+H-H2O]+ 319.217410 175.8
[M+HCOO]- 381.218351 207.2
[M+CH3COO]- 395.234001 220.6
[M+Na-2H]- 357.194816 185.3
[M]+ 336.21960142 185.1
[M]- 336.22069858 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.