CID 217721

Dtxsid70960127

Structural Information

Molecular Formula
C19H24N2O2
SMILES
CCCCNCC(=O)NC1=C(C=C(C=C1)OC2=CC=CC=C2)C
InChI
InChI=1S/C19H24N2O2/c1-3-4-12-20-14-19(22)21-18-11-10-17(13-15(18)2)23-16-8-6-5-7-9-16/h5-11,13,20H,3-4,12,14H2,1-2H3,(H,21,22)
InChIKey
QGBFUMSKKWXGLJ-UHFFFAOYSA-N
Compound name
2-(butylamino)-N-(2-methyl-4-phenoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.18378 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.191056 176.1
[M+Na]+ 335.172998 180.5
[M-H]- 311.176504 182.1
[M+NH4]+ 330.217603 189.9
[M+K]+ 351.146938 176.5
[M+H-H2O]+ 295.181040 167.1
[M+HCOO]- 357.181981 200.4
[M+CH3COO]- 371.197631 212.7
[M+Na-2H]- 333.158446 179.5
[M]+ 312.18323142 177.6
[M]- 312.18432858 177.6
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.