CID 3024417

Sch 1503

Structural Information

Molecular Formula
C21H34N2O3
SMILES
CCN(CC)CCCNC(=O)C(C)(C)OC1=C(C=C(C=C1)CC=C)OC
InChI
InChI=1S/C21H34N2O3/c1-7-11-17-12-13-18(19(16-17)25-6)26-21(4,5)20(24)22-14-10-15-23(8-2)9-3/h7,12-13,16H,1,8-11,14-15H2,2-6H3,(H,22,24)
InChIKey
IVDZJIMVSWUCIM-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]-2-(2-methoxy-4-prop-2-enylphenoxy)-2-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.25696 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.26424 193.2
[M+Na]+ 385.24618 196.3
[M-H]- 361.24968 196.9
[M+NH4]+ 380.29078 206.1
[M+K]+ 401.22012 194.4
[M+H-H2O]+ 345.25422 185.0
[M+HCOO]- 407.25516 214.7
[M+CH3COO]- 421.27081 228.0
[M+Na-2H]- 383.23163 193.2
[M]+ 362.25641 199.7
[M]- 362.25751 199.7
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.