CID 92975912

Ns00061777

Structural Information

Molecular Formula
C11H18O2
SMILES
C[C@]12CCC[C@](C1OC=O)(CC2)C
InChI
InChI=1S/C11H18O2/c1-10-4-3-5-11(2,7-6-10)9(10)13-8-12/h8-9H,3-7H2,1-2H3/t9?,10-,11+
InChIKey
WDZYJGQARPJWOY-FGWVZKOKSA-N
Compound name
[(1S,5R)-1,5-dimethyl-8-bicyclo[3.2.1]octanyl] formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.13068 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.137956 141.3
[M+Na]+ 205.119898 148.7
[M-H]- 181.123404 144.0
[M+NH4]+ 200.164503 168.6
[M+K]+ 221.093838 146.7
[M+H-H2O]+ 165.127940 137.5
[M+HCOO]- 227.128881 160.3
[M+CH3COO]- 241.144531 181.1
[M+Na-2H]- 203.105346 147.7
[M]+ 182.13013142 140.8
[M]- 182.13122858 140.8
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.