CID 43135453

[(3-bromopropoxy)methyl]cyclopropane

Structural Information

Molecular Formula
C7H13BrO
SMILES
C1CC1COCCCBr
InChI
InChI=1S/C7H13BrO/c8-4-1-5-9-6-7-2-3-7/h7H,1-6H2
InChIKey
ZCUOQSASUNXEIP-UHFFFAOYSA-N
Compound name
3-bromopropoxymethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.01498 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.02226 127.4
[M+Na]+ 215.00420 131.0
[M+NH4]+ 210.04880 133.3
[M+K]+ 230.97814 132.0
[M-H]- 191.00770 133.3
[M+Na-2H]- 212.98965 132.8
[M]+ 192.01443 129.3
[M]- 192.01553 129.3
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.