CID 122202450

2019992-04-0

Structural Information

Molecular Formula
C10H16O3
SMILES
COC(=O)OC1C2CCCC1CC2
InChI
InChI=1S/C10H16O3/c1-12-10(11)13-9-7-3-2-4-8(9)6-5-7/h7-9H,2-6H2,1H3
InChIKey
KNMNJFDLLVQHSG-UHFFFAOYSA-N
Compound name
8-bicyclo[3.2.1]octanyl methyl carbonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

184.10994 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.117216 140.9
[M+Na]+ 207.099158 146.4
[M-H]- 183.102664 143.1
[M+NH4]+ 202.143763 164.1
[M+K]+ 223.073098 145.7
[M+H-H2O]+ 167.107200 136.1
[M+HCOO]- 229.108141 159.5
[M+CH3COO]- 243.123791 180.3
[M+Na-2H]- 205.084606 144.4
[M]+ 184.10939142 140.0
[M]- 184.11048858 140.0
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.