CID 130694078

[(2s)-1-(prop-2-yn-1-yl)piperidin-2-yl]methanol

Structural Information

Molecular Formula
C9H15NO
SMILES
C#CCN1CCCC[C@H]1CO
InChI
InChI=1S/C9H15NO/c1-2-6-10-7-4-3-5-9(10)8-11/h1,9,11H,3-8H2/t9-/m0/s1
InChIKey
BOCPKNYINBEMCP-VIFPVBQESA-N
Compound name
[(2S)-1-prop-2-ynylpiperidin-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.122646 131.6
[M+Na]+ 176.104588 139.3
[M-H]- 152.108094 130.7
[M+NH4]+ 171.149193 148.6
[M+K]+ 192.078528 135.8
[M+H-H2O]+ 136.112630 119.8
[M+HCOO]- 198.113571 144.3
[M+CH3COO]- 212.129221 182.8
[M+Na-2H]- 174.090036 135.4
[M]+ 153.11482142 122.3
[M]- 153.11591858 122.3
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.