CID 215840

74-86 r & c

Structural Information

Molecular Formula
C26H36N2O
SMILES
CN(CCC1=CC=CC=C1)CCN(C)C(=O)CC2(CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C26H36N2O/c1-27(19-16-23-12-6-3-7-13-23)20-21-28(2)25(29)22-26(17-10-5-11-18-26)24-14-8-4-9-15-24/h3-4,6-9,12-15H,5,10-11,16-22H2,1-2H3
InChIKey
FRVRZBBLYPSAOP-UHFFFAOYSA-N
Compound name
N-methyl-N-[2-[methyl(2-phenylethyl)amino]ethyl]-2-(1-phenylcyclohexyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.28278 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.29006 201.7
[M+Na]+ 415.27200 200.6
[M-H]- 391.27550 211.0
[M+NH4]+ 410.31660 213.9
[M+K]+ 431.24594 197.5
[M+H-H2O]+ 375.28004 190.5
[M+HCOO]- 437.28098 221.2
[M+CH3COO]- 451.29663 232.0
[M+Na-2H]- 413.25745 201.8
[M]+ 392.28223 199.1
[M]- 392.28333 199.1
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.