CID 74935477

Dtxsid10888891

Structural Information

Molecular Formula

C₁₀H₁₆O

SMILES

CC=C1CC2CC1CC2OC

InChI

InChI=1S/C10H16O/c1-3-7-4-9-5-8(7)6-10(9)11-2/h3,8-10H,4-6H2,1-2H3

InChIKey

RTJUCQKPXNDVIS-UHFFFAOYSA-N

Compound name

2-ethylidene-5-methoxybicyclo[2.2.1]heptane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 0
Patents: 152.12012 Da
Monoisotopic Mass: 1.7
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]+	153.127396	136.1
[M+Na]+	175.109338	143.9
[M-H]-	151.112844	139.0
[M+NH4]+	170.153943	162.9
[M+K]+	191.083278	141.7
[M+H-H2O]+	135.117380	132.4
[M+HCOO]-	197.118321	157.5
[M+CH3COO]-	211.133971	177.4
[M+Na-2H]-	173.094786	138.7
[M]+	152.11957142	135.6
[M]-	152.12066858	135.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.