CID 101418270

Epoxycampholenic aldehyde

Structural Information

Molecular Formula
C10H16O2
SMILES
CC1(C(CC2C1(O2)C)CC=O)C
InChI
InChI=1S/C10H16O2/c1-9(2)7(4-5-11)6-8-10(9,3)12-8/h5,7-8H,4,6H2,1-3H3
InChIKey
OSNRGQATWCHICL-UHFFFAOYSA-N
Compound name
2-(1,2,2-trimethyl-6-oxabicyclo[3.1.0]hexan-3-yl)acetaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 137.8
[M+Na]+ 191.10426 150.1
[M+NH4]+ 186.14886 149.9
[M+K]+ 207.07820 144.1
[M-H]- 167.10776 147.3
[M+Na-2H]- 189.08971 145.9
[M]+ 168.11449 143.7
[M]- 168.11559 143.7
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.