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

5
Patents

162.00441 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.01169 127.1
[M+Na]+ 184.99363 141.3
[M-H]- 160.99713 135.1
[M+NH4]+ 180.03823 149.0
[M+K]+ 200.96757 131.6
[M+H-H2O]+ 145.00167 128.6
[M+HCOO]- 207.00261 148.6
[M+CH3COO]- 221.01826 180.9
[M+Na-2H]- 182.97908 136.3
[M]+ 162.00386 147.9
[M]- 162.00496 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