CID 102293800

2-(2-bromophenyl)-2-methyloxetane

Structural Information

Molecular Formula
C10H11BrO
SMILES
CC1(CCO1)C2=CC=CC=C2Br
InChI
InChI=1S/C10H11BrO/c1-10(6-7-12-10)8-4-2-3-5-9(8)11/h2-5H,6-7H2,1H3
InChIKey
BWBBTEQNECEZAM-UHFFFAOYSA-N
Compound name
2-(2-bromophenyl)-2-methyloxetane
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 129.8
[M+Na]+ 248.98855 140.4
[M-H]- 224.99205 139.9
[M+NH4]+ 244.03315 146.5
[M+K]+ 264.96249 134.5
[M+H-H2O]+ 208.99659 126.8
[M+HCOO]- 270.99753 149.8
[M+CH3COO]- 285.01318 188.7
[M+Na-2H]- 246.97400 140.2
[M]+ 225.99878 156.5
[M]- 225.99988 156.5
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.