CID 25662

Alpha-(2-(dimethylamino)ethyl)-alpha-ethylbenzyl alcohol hydrochloride

Structural Information

Molecular Formula
C13H21NO
SMILES
CCC(CCN(C)C)(C1=CC=CC=C1)O
InChI
InChI=1S/C13H21NO/c1-4-13(15,10-11-14(2)3)12-8-6-5-7-9-12/h5-9,15H,4,10-11H2,1-3H3
InChIKey
SNVUWIFPJAVATJ-UHFFFAOYSA-N
Compound name
1-(dimethylamino)-3-phenylpentan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.16231 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.16959 150.1
[M+Na]+ 230.15153 160.9
[M+NH4]+ 225.19613 158.3
[M+K]+ 246.12547 154.8
[M-H]- 206.15503 152.4
[M+Na-2H]- 228.13698 156.7
[M]+ 207.16176 152.3
[M]- 207.16286 152.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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No patent data available for this compound.