CID 121299

Brn 1039723

Structural Information

Molecular Formula
C21H32N2O4
SMILES
CCN(CC)C(=O)COC1=C(C=C(C=C1OC)CC=C)CN2CCOCC2
InChI
InChI=1S/C21H32N2O4/c1-5-8-17-13-18(15-22-9-11-26-12-10-22)21(19(14-17)25-4)27-16-20(24)23(6-2)7-3/h5,13-14H,1,6-12,15-16H2,2-4H3
InChIKey
HUNGSSMGRUTDLO-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[2-methoxy-6-(morpholin-4-ylmethyl)-4-prop-2-enylphenoxy]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.2362 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.24348 195.2
[M+Na]+ 399.22542 197.8
[M-H]- 375.22892 200.8
[M+NH4]+ 394.27002 204.5
[M+K]+ 415.19936 196.7
[M+H-H2O]+ 359.23346 185.0
[M+HCOO]- 421.23440 212.3
[M+CH3COO]- 435.25005 225.4
[M+Na-2H]- 397.21087 193.8
[M]+ 376.23565 198.9
[M]- 376.23675 198.9
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.