CID 14258974

4,10-epoxy-11-spirovetiven-2-one

Structural Information

Molecular Formula
C15H22O2
SMILES
CC(=C)C1CCC2(C1)C3CC(=O)CC2(OC3)C
InChI
InChI=1S/C15H22O2/c1-10(2)11-4-5-15(7-11)12-6-13(16)8-14(15,3)17-9-12/h11-12H,1,4-9H2,2-3H3
InChIKey
YHIWYGHFGRMQMO-UHFFFAOYSA-N
Compound name
5-methyl-3'-prop-1-en-2-ylspiro[6-oxabicyclo[3.2.1]octane-8,1'-cyclopentane]-3-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

234.16199 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.16927 155.9
[M+Na]+ 257.15121 164.0
[M+NH4]+ 252.19581 167.8
[M+K]+ 273.12515 158.3
[M-H]- 233.15471 158.7
[M+Na-2H]- 255.13666 159.0
[M]+ 234.16144 157.9
[M]- 234.16254 157.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe