CID 199416

4150-93-0

Structural Information

Molecular Formula
C20H23NO
SMILES
CC(CN(C)C)C(C#CC1=CC=CC=C1)(C2=CC=CC=C2)O
InChI
InChI=1S/C20H23NO/c1-17(16-21(2)3)20(22,19-12-8-5-9-13-19)15-14-18-10-6-4-7-11-18/h4-13,17,22H,16H2,1-3H3
InChIKey
PBLGECCGXYZHSI-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-4-methyl-1,3-diphenylpent-1-yn-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.17798 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.18526 175.2
[M+Na]+ 316.16720 187.0
[M+NH4]+ 311.21180 179.6
[M+K]+ 332.14114 176.7
[M-H]- 292.17070 171.3
[M+Na-2H]- 314.15265 180.1
[M]+ 293.17743 175.1
[M]- 293.17853 175.1
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.