CID 155978340

(6-bromo-2,3-dihydro-1h-inden-5-yl)methanol

Structural Information

Molecular Formula
C10H11BrO
SMILES
C1CC2=CC(=C(C=C2C1)Br)CO
InChI
InChI=1S/C10H11BrO/c11-10-5-8-3-1-2-7(8)4-9(10)6-12/h4-5,12H,1-3,6H2
InChIKey
SZALOIWKBWGXQN-UHFFFAOYSA-N
Compound name
(6-bromo-2,3-dihydro-1H-inden-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.99933 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.00661 145.2
[M+Na]+ 248.98855 157.1
[M-H]- 224.99205 151.3
[M+NH4]+ 244.03315 169.4
[M+K]+ 264.96249 145.6
[M+H-H2O]+ 208.99659 146.4
[M+HCOO]- 270.99753 165.0
[M+CH3COO]- 285.01318 184.2
[M+Na-2H]- 246.97400 151.4
[M]+ 225.99878 162.5
[M]- 225.99988 162.5
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.