CID 15835752

2-(bromomethyl)-1,1-dimethylcyclopropane

Structural Information

Molecular Formula
C6H11Br
SMILES
CC1(CC1CBr)C
InChI
InChI=1S/C6H11Br/c1-6(2)3-5(6)4-7/h5H,3-4H2,1-2H3
InChIKey
XMQINJYPBUNQJO-UHFFFAOYSA-N
Compound name
2-(bromomethyl)-1,1-dimethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

162.00441 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.011686 127.1
[M+Na]+ 184.993628 141.3
[M-H]- 160.997134 135.1
[M+NH4]+ 180.038233 149.0
[M+K]+ 200.967568 131.6
[M+H-H2O]+ 145.001670 128.6
[M+HCOO]- 207.002611 148.6
[M+CH3COO]- 221.018261 180.9
[M+Na-2H]- 182.979076 136.3
[M]+ 162.00386142 147.9
[M]- 162.00495858 147.9
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

patents stripe