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

1
Patents

382.26202 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.26930 199.5
[M+Na]+ 405.25124 201.7
[M-H]- 381.25474 205.9
[M+NH4]+ 400.29584 210.9
[M+K]+ 421.22518 198.0
[M+H-H2O]+ 365.25928 189.2
[M+HCOO]- 427.26022 222.5
[M+CH3COO]- 441.27587 230.8
[M+Na-2H]- 403.23669 199.4
[M]+ 382.26147 203.9
[M]- 382.26257 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