CID 33900

27471-59-6

Structural Information

Molecular Formula
C22H28N2O4
SMILES
COC1=CC=C(C=C1)OCC(=O)N(CCN2CCCC2)C3=CC=CC=C3OC
InChI
InChI=1S/C22H28N2O4/c1-26-18-9-11-19(12-10-18)28-17-22(25)24(16-15-23-13-5-6-14-23)20-7-3-4-8-21(20)27-2/h3-4,7-12H,5-6,13-17H2,1-2H3
InChIKey
BJCFQZOFDDHTBI-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)-N-(2-pyrrolidin-1-ylethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.2049 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.21218 193.0
[M+Na]+ 407.19412 195.6
[M-H]- 383.19762 201.6
[M+NH4]+ 402.23872 204.4
[M+K]+ 423.16806 193.6
[M+H-H2O]+ 367.20216 182.3
[M+HCOO]- 429.20310 214.1
[M+CH3COO]- 443.21875 223.0
[M+Na-2H]- 405.17957 192.0
[M]+ 384.20435 196.1
[M]- 384.20545 196.1
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.