CID 122164136

(2-bromo-1-methoxyethyl)cyclopentane

Structural Information

Molecular Formula
C8H15BrO
SMILES
COC(CBr)C1CCCC1
InChI
InChI=1S/C8H15BrO/c1-10-8(6-9)7-4-2-3-5-7/h7-8H,2-6H2,1H3
InChIKey
LDKRXSVVYQCAFO-UHFFFAOYSA-N
Compound name
(2-bromo-1-methoxyethyl)cyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.03062 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.037896 145.1
[M+Na]+ 229.019838 154.1
[M-H]- 205.023344 150.6
[M+NH4]+ 224.064443 169.1
[M+K]+ 244.993778 144.8
[M+H-H2O]+ 189.027880 145.5
[M+HCOO]- 251.028821 164.5
[M+CH3COO]- 265.044471 182.7
[M+Na-2H]- 227.005286 149.0
[M]+ 206.03007142 161.7
[M]- 206.03116858 161.7
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.