CID 28413996

[(2-bromoethoxy)methyl]cyclopropane

Structural Information

Molecular Formula
C6H11BrO
SMILES
C1CC1COCCBr
InChI
InChI=1S/C6H11BrO/c7-3-4-8-5-6-1-2-6/h6H,1-5H2
InChIKey
NUCYWTUUCLZIPH-UHFFFAOYSA-N
Compound name
2-bromoethoxymethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

177.99933 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.006606 132.7
[M+Na]+ 200.988548 145.3
[M-H]- 176.992054 139.8
[M+NH4]+ 196.033153 151.8
[M+K]+ 216.962488 135.1
[M+H-H2O]+ 160.996590 132.4
[M+HCOO]- 222.997531 154.6
[M+CH3COO]- 237.013181 182.0
[M+Na-2H]- 198.973996 141.1
[M]+ 177.99878142 153.8
[M]- 177.99987858 153.8
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

patents stripe