CID 134451841

1-oxadispiro[2.2.2^{6}.2^{3}]decane

Structural Information

Molecular Formula
C9H14O
SMILES
C1CC12CCC3(CC2)CO3
InChI
InChI=1S/C9H14O/c1-2-8(1)3-5-9(6-4-8)7-10-9/h1-7H2
InChIKey
FPBDEBMUNWEBRD-UHFFFAOYSA-N
Compound name
8-oxadispiro[2.2.26.23]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

138.10446 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.111736 145.4
[M+Na]+ 161.093678 152.2
[M-H]- 137.097184 153.9
[M+NH4]+ 156.138283 157.8
[M+K]+ 177.067618 155.8
[M+H-H2O]+ 121.101720 140.7
[M+HCOO]- 183.102661 161.0
[M+CH3COO]- 197.118311 156.1
[M+Na-2H]- 159.079126 152.4
[M]+ 138.10391142 146.5
[M]- 138.10500858 146.5
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

patents stripe