CID 137949005

2-[1-(bromomethyl)cyclopropyl]oxolane

Structural Information

Molecular Formula
C8H13BrO
SMILES
C1CC(OC1)C2(CC2)CBr
InChI
InChI=1S/C8H13BrO/c9-6-8(3-4-8)7-2-1-5-10-7/h7H,1-6H2
InChIKey
UPMLQGZPYOPRMS-UHFFFAOYSA-N
Compound name
2-[1-(bromomethyl)cyclopropyl]oxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.01498 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.022256 139.9
[M+Na]+ 227.004198 151.9
[M-H]- 203.007704 150.2
[M+NH4]+ 222.048803 160.0
[M+K]+ 242.978138 143.6
[M+H-H2O]+ 187.012240 140.9
[M+HCOO]- 249.013181 159.5
[M+CH3COO]- 263.028831 183.4
[M+Na-2H]- 224.989646 147.6
[M]+ 204.01443142 158.7
[M]- 204.01552858 158.7
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.