CID 209989

20809-20-5

Structural Information

Molecular Formula
C17H27NO2
SMILES
CCC(=O)C1=CC=CC=C1OCCN(C(C)C)C(C)C
InChI
InChI=1S/C17H27NO2/c1-6-16(19)15-9-7-8-10-17(15)20-12-11-18(13(2)3)14(4)5/h7-10,13-14H,6,11-12H2,1-5H3
InChIKey
BXLCWSUTZFEDJY-UHFFFAOYSA-N
Compound name
1-[2-[2-[di(propan-2-yl)amino]ethoxy]phenyl]propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

277.2042 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.211476 170.4
[M+Na]+ 300.193418 174.1
[M-H]- 276.196924 174.5
[M+NH4]+ 295.238023 186.8
[M+K]+ 316.167358 173.5
[M+H-H2O]+ 260.201460 163.0
[M+HCOO]- 322.202401 191.5
[M+CH3COO]- 336.218051 210.6
[M+Na-2H]- 298.178866 169.4
[M]+ 277.20365142 174.4
[M]- 277.20474858 174.4
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.