CID 10820689

1-bromospiro[2.2]pentane

Structural Information

Molecular Formula
C5H7Br
SMILES
C1CC12CC2Br
InChI
InChI=1S/C5H7Br/c6-4-3-5(4)1-2-5/h4H,1-3H2
InChIKey
PCOQWADEUQYEKD-UHFFFAOYSA-N
Compound name
2-bromospiro[2.2]pentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.97311 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.98039 136.9
[M+Na]+ 168.96233 149.4
[M-H]- 144.96583 146.1
[M+NH4]+ 164.00693 152.3
[M+K]+ 184.93627 142.1
[M+H-H2O]+ 128.97037 137.5
[M+HCOO]- 190.97131 155.6
[M+CH3COO]- 204.98696 186.7
[M+Na-2H]- 166.94778 144.7
[M]+ 145.97256 155.1
[M]- 145.97366 155.1
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.