CID 3046009

Acetamide, 2-(dibutylamino)-n-(2-methyl-4-(phenylmethoxy)phenyl)-, monohydrochloride

Structural Information

Molecular Formula
C24H34N2O2
SMILES
CCCCN(CCCC)CC(=O)NC1=C(C=C(C=C1)OCC2=CC=CC=C2)C
InChI
InChI=1S/C24H34N2O2/c1-4-6-15-26(16-7-5-2)18-24(27)25-23-14-13-22(17-20(23)3)28-19-21-11-9-8-10-12-21/h8-14,17H,4-7,15-16,18-19H2,1-3H3,(H,25,27)
InChIKey
XUZNZSXMFPVKPV-UHFFFAOYSA-N
Compound name
2-(dibutylamino)-N-(2-methyl-4-phenylmethoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.26202 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.269296 199.5
[M+Na]+ 405.251238 201.7
[M-H]- 381.254744 205.9
[M+NH4]+ 400.295843 210.9
[M+K]+ 421.225178 198.0
[M+H-H2O]+ 365.259280 189.2
[M+HCOO]- 427.260221 222.5
[M+CH3COO]- 441.275871 230.8
[M+Na-2H]- 403.236686 199.4
[M]+ 382.26147142 203.9
[M]- 382.26256858 203.9
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

patents stripe