CID 10588118

2-({[4-(benzyloxy)phenyl]methyl}amino)acetamide

Structural Information

Molecular Formula
C16H18N2O2
SMILES
C1=CC=C(C=C1)COC2=CC=C(C=C2)CNCC(=O)N
InChI
InChI=1S/C16H18N2O2/c17-16(19)11-18-10-13-6-8-15(9-7-13)20-12-14-4-2-1-3-5-14/h1-9,18H,10-12H2,(H2,17,19)
InChIKey
QPCKNQVICWJWJF-UHFFFAOYSA-N
Compound name
2-[(4-phenylmethoxyphenyl)methylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

14
Patents

270.13684 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.14412 162.3
[M+Na]+ 293.12606 167.1
[M-H]- 269.12956 168.0
[M+NH4]+ 288.17066 177.2
[M+K]+ 309.10000 163.3
[M+H-H2O]+ 253.13410 153.7
[M+HCOO]- 315.13504 187.0
[M+CH3COO]- 329.15069 202.6
[M+Na-2H]- 291.11151 167.1
[M]+ 270.13629 161.5
[M]- 270.13739 161.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe