CID 10965462

1-bromo-2,3-dihydro-1h-indene

Structural Information

Molecular Formula
C9H9Br
SMILES
C1CC2=CC=CC=C2C1Br
InChI
InChI=1S/C9H9Br/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6H2
InChIKey
BVMGTUJYIOYCBX-UHFFFAOYSA-N
Compound name
1-bromo-2,3-dihydro-1H-indene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

199
Patents

195.98875 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.99603 136.3
[M+Na]+ 218.97797 140.0
[M+NH4]+ 214.02257 143.3
[M+K]+ 234.95191 139.9
[M-H]- 194.98147 138.0
[M+Na-2H]- 216.96342 139.9
[M]+ 195.98820 136.2
[M]- 195.98930 136.2
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

patents stripe