CID 145912935

2154180-61-5

Structural Information

Molecular Formula
C11H19NO
SMILES
CC1(CCCN(C1)CCC#C)CO
InChI
InChI=1S/C11H19NO/c1-3-4-7-12-8-5-6-11(2,9-12)10-13/h1,13H,4-10H2,2H3
InChIKey
HIFNGRACCBTMMB-UHFFFAOYSA-N
Compound name
(1-but-3-ynyl-3-methylpiperidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.14667 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.153946 139.7
[M+Na]+ 204.135888 147.7
[M-H]- 180.139394 139.0
[M+NH4]+ 199.180493 157.6
[M+K]+ 220.109828 143.4
[M+H-H2O]+ 164.143930 128.4
[M+HCOO]- 226.144871 151.9
[M+CH3COO]- 240.160521 187.8
[M+Na-2H]- 202.121336 143.5
[M]+ 181.14612142 131.4
[M]- 181.14721858 131.4
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.