CID 218056

4-ethynyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-ol

Structural Information

Molecular Formula
C17H21NO
SMILES
C#CC1(CCN(CC1)C2CCC3=CC=CC=C3C2)O
InChI
InChI=1S/C17H21NO/c1-2-17(19)9-11-18(12-10-17)16-8-7-14-5-3-4-6-15(14)13-16/h1,3-6,16,19H,7-13H2
InChIKey
ZEGXFGQSFILBAM-UHFFFAOYSA-N
Compound name
4-ethynyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.16231 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.16959 165.0
[M+Na]+ 278.15153 177.2
[M+NH4]+ 273.19613 171.8
[M+K]+ 294.12547 164.3
[M-H]- 254.15503 160.9
[M+Na-2H]- 276.13698 168.9
[M]+ 255.16176 164.9
[M]- 255.16286 164.9
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.