CID 37384

Diamfenetide

Structural Information

Molecular Formula
C20H24N2O5
SMILES
CC(=O)NC1=CC=C(C=C1)OCCOCCOC2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C20H24N2O5/c1-15(23)21-17-3-7-19(8-4-17)26-13-11-25-12-14-27-20-9-5-18(6-10-20)22-16(2)24/h3-10H,11-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKey
JNEZCZPNQCQCFK-UHFFFAOYSA-N
Compound name
N-[4-[2-[2-(4-acetamidophenoxy)ethoxy]ethoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

46
References

1298
Patents

372.16852 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.17580 188.2
[M+Na]+ 395.15774 191.6
[M-H]- 371.16124 194.1
[M+NH4]+ 390.20234 199.1
[M+K]+ 411.13168 189.5
[M+H-H2O]+ 355.16578 178.3
[M+HCOO]- 417.16672 211.9
[M+CH3COO]- 431.18237 221.6
[M+Na-2H]- 393.14319 190.3
[M]+ 372.16797 192.9
[M]- 372.16907 192.9
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