CID 101409164

3,4-epoxy-p-menth-1(7)-ene

Structural Information

Molecular Formula
C10H16O
SMILES
CC(C)C12CCC(=C)CC1O2
InChI
InChI=1S/C10H16O/c1-7(2)10-5-4-8(3)6-9(10)11-10/h7,9H,3-6H2,1-2H3
InChIKey
ITEDXWDCHPDNGM-UHFFFAOYSA-N
Compound name
4-methylidene-1-propan-2-yl-7-oxabicyclo[4.1.0]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.12012 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.12740 134.9
[M+Na]+ 175.10934 147.8
[M+NH4]+ 170.15394 146.3
[M+K]+ 191.08328 141.5
[M-H]- 151.11284 145.2
[M+Na-2H]- 173.09479 142.8
[M]+ 152.11957 141.0
[M]- 152.12067 141.0
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.