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]+ 306.217606 177.9
[M+Na]+ 328.199548 180.9
[M-H]- 304.203054 183.3
[M+NH4]+ 323.244153 193.2
[M+K]+ 344.173488 180.3
[M+H-H2O]+ 288.207590 169.1
[M+HCOO]- 350.208531 203.7
[M+CH3COO]- 364.224181 219.5
[M+Na-2H]- 326.184996 179.2
[M]+ 305.20978142 181.9
[M]- 305.21087858 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.