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

10
Patents

177.99933 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.006606 121.5
[M+Na]+ 200.988548 130.7
[M-H]- 176.992054 127.5
[M+NH4]+ 196.033153 139.1
[M+K]+ 216.962488 124.5
[M+H-H2O]+ 160.996590 117.9
[M+HCOO]- 222.997531 141.8
[M+CH3COO]- 237.013181 181.6
[M+Na-2H]- 198.973996 130.2
[M]+ 177.99878142 147.4
[M]- 177.99987858 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