CID 215278

35366-24-6

Structural Information

Molecular Formula
C18H28ClNO
SMILES
CCOC1=C(C=C(C=C1)Cl)C(CN(C)C)C2CCCCC2
InChI
InChI=1S/C18H28ClNO/c1-4-21-18-11-10-15(19)12-16(18)17(13-20(2)3)14-8-6-5-7-9-14/h10-12,14,17H,4-9,13H2,1-3H3
InChIKey
HGCOPLMHTQQJJG-UHFFFAOYSA-N
Compound name
2-(5-chloro-2-ethoxyphenyl)-2-cyclohexyl-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.18594 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.19322 176.5
[M+Na]+ 332.17516 179.9
[M-H]- 308.17866 182.9
[M+NH4]+ 327.21976 192.3
[M+K]+ 348.14910 176.2
[M+H-H2O]+ 292.18320 168.9
[M+HCOO]- 354.18414 191.4
[M+CH3COO]- 368.19979 212.1
[M+Na-2H]- 330.16061 175.8
[M]+ 309.18539 177.0
[M]- 309.18649 177.0
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.