CID 14919416

1-(2-bromoethyl)cyclopent-1-ene

Structural Information

Molecular Formula
C7H11Br
SMILES
C1CC=C(C1)CCBr
InChI
InChI=1S/C7H11Br/c8-6-5-7-3-1-2-4-7/h3H,1-2,4-6H2
InChIKey
NHAQKUYXUSXSAS-UHFFFAOYSA-N
Compound name
1-(2-bromoethyl)cyclopentene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

174.00441 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.011686 134.0
[M+Na]+ 196.993628 144.8
[M-H]- 172.997134 140.0
[M+NH4]+ 192.038233 159.4
[M+K]+ 212.967568 134.8
[M+H-H2O]+ 157.001670 134.9
[M+HCOO]- 219.002611 156.0
[M+CH3COO]- 233.018261 177.1
[M+Na-2H]- 194.979076 140.8
[M]+ 174.00386142 151.0
[M]- 174.00495858 151.0
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