CID 95330

Exo-2-methoxybornane

Structural Information

Molecular Formula

C₁₁H₂₀O

SMILES

CC1(C2CCC1(C(C2)OC)C)C

InChI

InChI=1S/C11H20O/c1-10(2)8-5-6-11(10,3)9(7-8)12-4/h8-9H,5-7H2,1-4H3

InChIKey

ZRHVOKYSOWTPIG-UHFFFAOYSA-N

Compound name

2-methoxy-1,7,7-trimethylbicyclo[2.2.1]heptane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 487
Patents: 168.15141 Da
Monoisotopic Mass: 3.3
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]+	169.15869	138.6
[M+Na]+	191.14063	147.7
[M+NH4]+	186.18523	151.4
[M+K]+	207.11457	141.3
[M-H]-	167.14413	139.4
[M+Na-2H]-	189.12608	143.0
[M]+	168.15086	140.4
[M]-	168.15196	140.4

Literature stripe

literature stripe

Patent stripe

patents stripe