CID 3072780

Acetamide, n-(((2-(diethylamino)ethyl)amino)(4-ethoxyphenyl)methylene)-, monohydrochloride

Structural Information

Molecular Formula
C17H27N3O2
SMILES
CCN(CC)CCN=C(C1=CC=C(C=C1)OCC)NC(=O)C
InChI
InChI=1S/C17H27N3O2/c1-5-20(6-2)13-12-18-17(19-14(4)21)15-8-10-16(11-9-15)22-7-3/h8-11H,5-7,12-13H2,1-4H3,(H,18,19,21)
InChIKey
XYXJYHFTLSDWCR-UHFFFAOYSA-N
Compound name
N-[N-[2-(diethylamino)ethyl]-C-(4-ethoxyphenyl)carbonimidoyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.21033 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.21761 177.9
[M+Na]+ 328.19955 180.9
[M-H]- 304.20305 183.3
[M+NH4]+ 323.24415 193.2
[M+K]+ 344.17349 180.3
[M+H-H2O]+ 288.20759 169.1
[M+HCOO]- 350.20853 203.7
[M+CH3COO]- 364.22418 219.5
[M+Na-2H]- 326.18500 179.2
[M]+ 305.20978 181.9
[M]- 305.21088 181.9
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.