CID 102347052

1-(bromomethyl)-1-(prop-2-en-1-yl)cyclopentane

Structural Information

Molecular Formula
C9H15Br
SMILES
C=CCC1(CCCC1)CBr
InChI
InChI=1S/C9H15Br/c1-2-5-9(8-10)6-3-4-7-9/h2H,1,3-8H2
InChIKey
SWYBYXKJBKFOLT-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-1-prop-2-enylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.0357 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.04298 142.1
[M+Na]+ 225.02492 152.2
[M-H]- 201.02842 147.8
[M+NH4]+ 220.06952 168.2
[M+K]+ 240.99886 141.4
[M+H-H2O]+ 185.03296 143.6
[M+HCOO]- 247.03390 162.3
[M+CH3COO]- 261.04955 181.8
[M+Na-2H]- 223.01037 148.0
[M]+ 202.03515 158.1
[M]- 202.03625 158.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.