CID 115640

Brn 1162502

Structural Information

Molecular Formula
C22H26N2O2
SMILES
C1COCCN1CCC(=O)NC2C(CC3=CC=CC=C23)C4=CC=CC=C4
InChI
InChI=1S/C22H26N2O2/c25-21(10-11-24-12-14-26-15-13-24)23-22-19-9-5-4-8-18(19)16-20(22)17-6-2-1-3-7-17/h1-9,20,22H,10-16H2,(H,23,25)
InChIKey
YMPJBUOORHWACE-UHFFFAOYSA-N
Compound name
3-morpholin-4-yl-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

350.19943 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.20671 184.5
[M+Na]+ 373.18865 186.9
[M-H]- 349.19215 192.6
[M+NH4]+ 368.23325 196.1
[M+K]+ 389.16259 182.7
[M+H-H2O]+ 333.19669 174.4
[M+HCOO]- 395.19763 200.5
[M+CH3COO]- 409.21328 192.9
[M+Na-2H]- 371.17410 185.3
[M]+ 350.19888 180.0
[M]- 350.19998 180.0
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.