CID 75456970

3-ethoxy-7-oxaspiro[3.5]nonan-1-ol

Structural Information

Molecular Formula
C10H18O3
SMILES
CCOC1CC(C12CCOCC2)O
InChI
InChI=1S/C10H18O3/c1-2-13-9-7-8(11)10(9)3-5-12-6-4-10/h8-9,11H,2-7H2,1H3
InChIKey
CHKDSMZFHOZVDI-UHFFFAOYSA-N
Compound name
3-ethoxy-7-oxaspiro[3.5]nonan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.1256 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.13288 135.0
[M+Na]+ 209.11482 139.2
[M-H]- 185.11832 139.5
[M+NH4]+ 204.15942 148.7
[M+K]+ 225.08876 142.4
[M+H-H2O]+ 169.12286 125.5
[M+HCOO]- 231.12380 151.6
[M+CH3COO]- 245.13945 181.5
[M+Na-2H]- 207.10027 141.3
[M]+ 186.12505 141.4
[M]- 186.12615 141.4
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.