CID 20057208

(r)-5-((1r)-menthyloxy)-2(5h)-furanone

Structural Information

Molecular Formula
C14H22O3
SMILES
C[C@@H]1CCC(C(C1)O[C@H]2C=CC(=O)O2)C(C)C
InChI
InChI=1S/C14H22O3/c1-9(2)11-5-4-10(3)8-12(11)16-14-7-6-13(15)17-14/h6-7,9-12,14H,4-5,8H2,1-3H3/t10-,11?,12?,14-/m1/s1
InChIKey
URWJVUPZIGIVFZ-MLCFOIATSA-N
Compound name
(2R)-2-[(5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-2H-furan-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

238.15689 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.16417 155.8
[M+Na]+ 261.14611 165.8
[M+NH4]+ 256.19071 163.7
[M+K]+ 277.12005 162.4
[M-H]- 237.14961 159.7
[M+Na-2H]- 259.13156 159.1
[M]+ 238.15634 158.1
[M]- 238.15744 158.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe