CID 206134

Sch 1808

Structural Information

Molecular Formula
C16H25ClN2O2
SMILES
CCN(CC)CCNC(=O)C(C)(C)OC1=CC=C(C=C1)Cl
InChI
InChI=1S/C16H25ClN2O2/c1-5-19(6-2)12-11-18-15(20)16(3,4)21-14-9-7-13(17)8-10-14/h7-10H,5-6,11-12H2,1-4H3,(H,18,20)
InChIKey
UCFLBYXMGOWZPX-UHFFFAOYSA-N
Compound name
2-(4-chlorophenoxy)-N-[2-(diethylamino)ethyl]-2-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.16046 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.16774 176.3
[M+Na]+ 335.14968 181.2
[M-H]- 311.15318 180.5
[M+NH4]+ 330.19428 192.0
[M+K]+ 351.12362 178.4
[M+H-H2O]+ 295.15772 169.7
[M+HCOO]- 357.15866 194.6
[M+CH3COO]- 371.17431 214.2
[M+Na-2H]- 333.13513 178.9
[M]+ 312.15991 182.0
[M]- 312.16101 182.0
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.