CID 145875160

4-(bromomethyl)-4-methylcyclopent-1-ene

Structural Information

Molecular Formula
C7H11Br
SMILES
CC1(CC=CC1)CBr
InChI
InChI=1S/C7H11Br/c1-7(6-8)4-2-3-5-7/h2-3H,4-6H2,1H3
InChIKey
UFRNDSJKAPYPFZ-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-4-methylcyclopentene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.00441 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.011686 131.8
[M+Na]+ 196.993628 143.4
[M-H]- 172.997134 138.2
[M+NH4]+ 192.038233 159.2
[M+K]+ 212.967568 133.6
[M+H-H2O]+ 157.001670 133.6
[M+HCOO]- 219.002611 153.9
[M+CH3COO]- 233.018261 176.7
[M+Na-2H]- 194.979076 139.8
[M]+ 174.00386142 149.2
[M]- 174.00495858 149.2
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

No patent data available for this compound.