CID 59196

102008-47-9

Structural Information

Molecular Formula
C19H24N2O2
SMILES
C1=CC=C(C=C1)CC(=O)NCCCCCOC2=CC=C(C=C2)N
InChI
InChI=1S/C19H24N2O2/c20-17-9-11-18(12-10-17)23-14-6-2-5-13-21-19(22)15-16-7-3-1-4-8-16/h1,3-4,7-12H,2,5-6,13-15,20H2,(H,21,22)
InChIKey
CCLVDHSIXUGPSY-UHFFFAOYSA-N
Compound name
N-[5-(4-aminophenoxy)pentyl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.18378 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.19106 176.1
[M+Na]+ 335.17300 179.5
[M-H]- 311.17650 181.2
[M+NH4]+ 330.21760 189.3
[M+K]+ 351.14694 175.1
[M+H-H2O]+ 295.18104 166.9
[M+HCOO]- 357.18198 199.8
[M+CH3COO]- 371.19763 210.9
[M+Na-2H]- 333.15845 179.3
[M]+ 312.18323 176.2
[M]- 312.18433 176.2
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