CID 210015

2-(1-methylpiperidin-4-yl)-2,3-dihydro-1h-inden-1-ol

Structural Information

Molecular Formula
C15H21NO
SMILES
CN1CCC(CC1)C2CC3=CC=CC=C3C2O
InChI
InChI=1S/C15H21NO/c1-16-8-6-11(7-9-16)14-10-12-4-2-3-5-13(12)15(14)17/h2-5,11,14-15,17H,6-10H2,1H3
InChIKey
FLNPMFIPMFSRQX-UHFFFAOYSA-N
Compound name
2-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-inden-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

231.16231 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.169586 155.0
[M+Na]+ 254.151528 160.8
[M-H]- 230.155034 159.2
[M+NH4]+ 249.196133 173.8
[M+K]+ 270.125468 156.3
[M+H-H2O]+ 214.159570 147.8
[M+HCOO]- 276.160511 171.3
[M+CH3COO]- 290.176161 166.0
[M+Na-2H]- 252.136976 156.2
[M]+ 231.16176142 149.4
[M]- 231.16285858 149.4
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

patents stripe