CID 129372242

(1s,2s)-1-(bromomethyl)-2-ethylcyclopropane

Structural Information

Molecular Formula
C6H11Br
SMILES
CC[C@H]1C[C@@H]1CBr
InChI
InChI=1S/C6H11Br/c1-2-5-3-6(5)4-7/h5-6H,2-4H2,1H3/t5-,6+/m0/s1
InChIKey
NWPQBWPIBCOXRW-NTSWFWBYSA-N
Compound name
(1S,2S)-1-(bromomethyl)-2-ethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.00441 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.01169 128.4
[M+Na]+ 184.99363 142.0
[M-H]- 160.99713 136.0
[M+NH4]+ 180.03823 148.5
[M+K]+ 200.96757 131.4
[M+H-H2O]+ 145.00167 128.5
[M+HCOO]- 207.00261 150.2
[M+CH3COO]- 221.01826 181.3
[M+Na-2H]- 182.97908 136.5
[M]+ 162.00386 148.6
[M]- 162.00496 148.6
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.