CID 16683961

Bismuth valerate, basic

Structural Information

Molecular Formula
C5H9BiO3
SMILES
CCCCC(=O)O[Bi]=O
InChI
InChI=1S/C5H10O2.Bi.O/c1-2-3-4-5(6)7;;/h2-4H2,1H3,(H,6,7);;/q;+1;/p-1
InChIKey
OLZYZWRTOLJEAJ-UHFFFAOYSA-M
Compound name
oxobismuthanyl pentanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

326.03558 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.042856 164.7
[M+Na]+ 349.024798 170.8
[M-H]- 325.028304 163.6
[M+NH4]+ 344.069403 184.6
[M+K]+ 364.998738 170.0
[M+H-H2O]+ 309.032840 158.1
[M+HCOO]- 371.033781 186.4
[M+CH3COO]- 385.049431 179.3
[M+Na-2H]- 347.010246 166.4
[M]+ 326.03503142 168.4
[M]- 326.03612858 168.4
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