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]+ 182.15395 139.7
[M+Na]+ 204.13589 147.7
[M-H]- 180.13939 139.0
[M+NH4]+ 199.18049 157.6
[M+K]+ 220.10983 143.4
[M+H-H2O]+ 164.14393 128.4
[M+HCOO]- 226.14487 151.9
[M+CH3COO]- 240.16052 187.8
[M+Na-2H]- 202.12134 143.5
[M]+ 181.14612 131.4
[M]- 181.14722 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.