CID 511456

1,6-methanonaphthalen-5-ol, decahydro-, (5r)-

Structural Information

Molecular Formula

C₁₁H₁₈O

SMILES

C1CC2CC3CCC2C(C1)[C@@H]3O

InChI

InChI=1S/C11H18O/c12-11-8-4-5-9-7(6-8)2-1-3-10(9)11/h7-12H,1-6H2/t7?,8?,9?,10?,11-/m1/s1

InChIKey

HEWREJMSVKMYAQ-LZTKIECASA-N

Compound name

(2R)-tricyclo[5.3.1.03,8]undecan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 166.13577 Da
Monoisotopic Mass: 2.7
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]+	167.14305	133.9
[M+Na]+	189.12499	136.6
[M-H]-	165.12849	131.1
[M+NH4]+	184.16959	158.3
[M+K]+	205.09893	133.6
[M+H-H2O]+	149.13303	128.8
[M+HCOO]-	211.13397	142.3
[M+CH3COO]-	225.14962	144.0
[M+Na-2H]-	187.11044	142.8
[M]+	166.13522	129.9
[M]-	166.13632	129.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.