CID 215276

35366-22-4

Structural Information

Molecular Formula
C17H26ClNO
SMILES
CCOC1=C(C=C(C=C1)Cl)C(CN(C)C)C2CCCC2
InChI
InChI=1S/C17H26ClNO/c1-4-20-17-10-9-14(18)11-15(17)16(12-19(2)3)13-7-5-6-8-13/h9-11,13,16H,4-8,12H2,1-3H3
InChIKey
XHDUEKCZURMCLE-UHFFFAOYSA-N
Compound name
2-(5-chloro-2-ethoxyphenyl)-2-cyclopentyl-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.1703 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.17758 174.2
[M+Na]+ 318.15952 179.0
[M-H]- 294.16302 181.2
[M+NH4]+ 313.20412 192.5
[M+K]+ 334.13346 175.2
[M+H-H2O]+ 278.16756 167.2
[M+HCOO]- 340.16850 191.5
[M+CH3COO]- 354.18415 208.7
[M+Na-2H]- 316.14497 172.5
[M]+ 295.16975 176.5
[M]- 295.17085 176.5
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.