CID 260917

Nortricyclanol

Structural Information

Molecular Formula

C₇H₁₀O

SMILES

C1C2CC3C1C3C2O

InChI

InChI=1S/C7H10O/c8-7-3-1-4-5(2-3)6(4)7/h3-8H,1-2H2

InChIKey

OZMQKGXJENMAHL-UHFFFAOYSA-N

Compound name

tricyclo[2.2.1.02,6]heptan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 110.073166 Da
Monoisotopic Mass: 0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	111.08044	114.0
[M+Na]+	133.06238	124.0
[M+NH4]+	128.10699	126.0
[M+K]+	149.03632	125.2
[M-H]-	109.06589	119.5
[M+Na-2H]-	131.04783	115.2
[M]+	110.07262	117.9
[M]-	110.07371	117.9

Literature stripe

literature stripe

Patent stripe

patents stripe