CID 213302

26082-86-0

Structural Information

Molecular Formula
C22H36N2O
SMILES
CCN(CC)CCC(=O)N(C1CCCCC1)C2=C(C=C(C=C2C)C)C
InChI
InChI=1S/C22H36N2O/c1-6-23(7-2)14-13-21(25)24(20-11-9-8-10-12-20)22-18(4)15-17(3)16-19(22)5/h15-16,20H,6-14H2,1-5H3
InChIKey
ZFFMBBPQUPFXRC-UHFFFAOYSA-N
Compound name
N-cyclohexyl-3-(diethylamino)-N-(2,4,6-trimethylphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.28278 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.29006 190.1
[M+Na]+ 367.27200 191.5
[M-H]- 343.27550 197.7
[M+NH4]+ 362.31660 204.1
[M+K]+ 383.24594 189.7
[M+H-H2O]+ 327.28004 180.9
[M+HCOO]- 389.28098 209.8
[M+CH3COO]- 403.29663 228.6
[M+Na-2H]- 365.25745 186.8
[M]+ 344.28223 189.9
[M]- 344.28333 190.0
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.