CID 17937327

(2-bromo-1-methoxyethyl)cyclopropane

Structural Information

Molecular Formula
C6H11BrO
SMILES
COC(CBr)C1CC1
InChI
InChI=1S/C6H11BrO/c1-8-6(4-7)5-2-3-5/h5-6H,2-4H2,1H3
InChIKey
INUCUAQICVRCSY-UHFFFAOYSA-N
Compound name
(2-bromo-1-methoxyethyl)cyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

177.99933 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.00661 132.8
[M+Na]+ 200.98855 145.2
[M-H]- 176.99205 140.0
[M+NH4]+ 196.03315 151.9
[M+K]+ 216.96249 135.3
[M+H-H2O]+ 160.99659 132.5
[M+HCOO]- 222.99753 153.9
[M+CH3COO]- 237.01318 182.7
[M+Na-2H]- 198.97400 140.1
[M]+ 177.99878 153.4
[M]- 177.99988 153.4
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