CID 25445

1-menthene

Structural Information

Molecular Formula

C₁₀H₁₈

SMILES

CC1=C(CCCC1)C(C)C

InChI

InChI=1S/C10H18/c1-8(2)10-7-5-4-6-9(10)3/h8H,4-7H2,1-3H3

InChIKey

JXMFWIFYAPYINL-UHFFFAOYSA-N

Compound name

1-methyl-2-propan-2-ylcyclohexene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 78
Patents: 138.14085 Da
Monoisotopic Mass: 3.1
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]+	139.14813	131.9
[M+Na]+	161.13007	144.0
[M+NH4]+	156.17467	141.9
[M+K]+	177.10401	137.0
[M-H]-	137.13357	134.9
[M+Na-2H]-	159.11552	138.2
[M]+	138.14030	134.5
[M]-	138.14140	134.5

Literature stripe

literature stripe

Patent stripe

patents stripe