CID 22130

2,3-epoxy-p-menthane

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CC1CCC(C2C1O2)C(C)C

InChI

InChI=1S/C10H18O/c1-6(2)8-5-4-7(3)9-10(8)11-9/h6-10H,4-5H2,1-3H3

InChIKey

DVDWHWOVXBYPFH-UHFFFAOYSA-N

Compound name

2-methyl-5-propan-2-yl-7-oxabicyclo[4.1.0]heptane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 154.13577 Da
Monoisotopic Mass: 2.9
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]+	155.14305	134.6
[M+Na]+	177.12499	143.3
[M-H]-	153.12849	140.6
[M+NH4]+	172.16959	151.2
[M+K]+	193.09893	142.5
[M+H-H2O]+	137.13303	128.9
[M+HCOO]-	199.13397	152.7
[M+CH3COO]-	213.14962	183.9
[M+Na-2H]-	175.11044	139.9
[M]+	154.13522	136.7
[M]-	154.13632	136.7

Literature stripe

literature stripe

Patent stripe

patents stripe