CID 82394700

4-(bromomethyl)-2,3-dihydro-1h-indene

Structural Information

Molecular Formula
C10H11Br
SMILES
C1CC2=C(C1)C(=CC=C2)CBr
InChI
InChI=1S/C10H11Br/c11-7-9-5-1-3-8-4-2-6-10(8)9/h1,3,5H,2,4,6-7H2
InChIKey
GDZLITXTJOYMAG-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-2,3-dihydro-1H-indene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.00441 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.01169 142.0
[M+Na]+ 232.99363 153.7
[M-H]- 208.99713 149.1
[M+NH4]+ 228.03823 167.3
[M+K]+ 248.96757 142.7
[M+H-H2O]+ 193.00167 143.1
[M+HCOO]- 255.00261 163.1
[M+CH3COO]- 269.01826 157.7
[M+Na-2H]- 230.97908 149.3
[M]+ 210.00386 159.4
[M]- 210.00496 159.4
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.