CID 260378

2-exo-norbornyl bromide

Structural Information

Molecular Formula
C7H11Br
SMILES
C1CC2CC1C[C@@H]2Br
InChI
InChI=1S/C7H11Br/c8-7-4-5-1-2-6(7)3-5/h5-7H,1-4H2/t5?,6?,7-/m0/s1
InChIKey
QXYOAWHKJRWNID-AHXFUIDQSA-N
Compound name
(2S)-2-bromobicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

174.00441 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.01169 139.0
[M+Na]+ 196.99363 150.5
[M-H]- 172.99713 144.7
[M+NH4]+ 192.03823 167.8
[M+K]+ 212.96757 140.7
[M+H-H2O]+ 157.00167 141.0
[M+HCOO]- 219.00261 158.7
[M+CH3COO]- 233.01826 154.8
[M+Na-2H]- 194.97908 144.3
[M]+ 174.00386 154.9
[M]- 174.00496 154.9
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.