CID 13837145

Bis(butan-2-yl)(chloro)phosphane

Structural Information

Molecular Formula
C8H18ClP
SMILES
CCC(C)P(C(C)CC)Cl
InChI
InChI=1S/C8H18ClP/c1-5-7(3)10(9)8(4)6-2/h7-8H,5-6H2,1-4H3
InChIKey
GHXFBMZOMNVURP-UHFFFAOYSA-N
Compound name
di(butan-2-yl)-chlorophosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

180.08347 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.09075 144.5
[M+Na]+ 203.07269 150.9
[M-H]- 179.07619 143.5
[M+NH4]+ 198.11729 166.3
[M+K]+ 219.04663 148.9
[M+H-H2O]+ 163.08073 138.8
[M+HCOO]- 225.08167 165.4
[M+CH3COO]- 239.09732 186.8
[M+Na-2H]- 201.05814 142.6
[M]+ 180.08292 148.3
[M]- 180.08402 148.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe