CID 92004572

1-ethoxy-p-menth-2-ene

Structural Information

Molecular Formula

C₁₂H₂₂O

SMILES

CCOC1(CCC(C=C1)C(C)C)C

InChI

InChI=1S/C12H22O/c1-5-13-12(4)8-6-11(7-9-12)10(2)3/h6,8,10-11H,5,7,9H2,1-4H3

InChIKey

VVTMUJNOAJKUIU-UHFFFAOYSA-N

Compound name

3-ethoxy-3-methyl-6-propan-2-ylcyclohexene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 182.16707 Da
Monoisotopic Mass: 3.2
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]+	183.17435	143.9
[M+Na]+	205.15629	155.3
[M+NH4]+	200.20089	154.4
[M+K]+	221.13023	146.7
[M-H]-	181.15979	146.4
[M+Na-2H]-	203.14174	150.8
[M]+	182.16652	146.4
[M]-	182.16762	146.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe