CID 441245

Limonene-1,2-epoxide

Structural Information

Molecular Formula
C10H16O
SMILES
CC(=C)[C@@H]1CCC2(C(C1)O2)C
InChI
InChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3/t8-,9?,10?/m1/s1
InChIKey
CCEFMUBVSUDRLG-XNWIYYODSA-N
Compound name
(4R)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptane
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

62
References

8134
Patents

152.12012 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.127396 134.4
[M+Na]+ 175.109338 143.2
[M-H]- 151.112844 140.4
[M+NH4]+ 170.153943 152.6
[M+K]+ 191.083278 142.9
[M+H-H2O]+ 135.117380 129.6
[M+HCOO]- 197.118321 152.4
[M+CH3COO]- 211.133971 181.5
[M+Na-2H]- 173.094786 141.3
[M]+ 152.11957142 135.8
[M]- 152.12066858 135.8
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

No patent data available for this compound.