CID 62142152

(2-bromoethoxy)cyclobutane

Structural Information

Molecular Formula
C6H11BrO
SMILES
C1CC(C1)OCCBr
InChI
InChI=1S/C6H11BrO/c7-4-5-8-6-2-1-3-6/h6H,1-5H2
InChIKey
IOGJSQPKPOTIOR-UHFFFAOYSA-N
Compound name
2-bromoethoxycyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

177.99933 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.00661 121.5
[M+Na]+ 200.98855 130.7
[M-H]- 176.99205 127.5
[M+NH4]+ 196.03315 139.1
[M+K]+ 216.96249 124.5
[M+H-H2O]+ 160.99659 117.9
[M+HCOO]- 222.99753 141.8
[M+CH3COO]- 237.01318 181.6
[M+Na-2H]- 198.97400 130.2
[M]+ 177.99878 147.4
[M]- 177.99988 147.4
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