CID 55913

89175-79-1

Structural Information

Molecular Formula
C9H19O4P
SMILES
CCCOP1(=O)C(CC(O1)(C)C)(C)O
InChI
InChI=1S/C9H19O4P/c1-5-6-12-14(11)9(4,10)7-8(2,3)13-14/h10H,5-7H2,1-4H3
InChIKey
JZFGQRUSUFQSBF-UHFFFAOYSA-N
Compound name
3,5,5-trimethyl-2-oxo-2-propoxy-1,2lambda5-oxaphospholan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.1021 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.109376 142.2
[M+Na]+ 245.091318 151.3
[M-H]- 221.094824 144.6
[M+NH4]+ 240.135923 167.3
[M+K]+ 261.065258 151.9
[M+H-H2O]+ 205.099360 138.5
[M+HCOO]- 267.100301 168.3
[M+CH3COO]- 281.115951 185.4
[M+Na-2H]- 243.076766 147.1
[M]+ 222.10155142 147.4
[M]- 222.10264858 147.4
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

No patent data available for this compound.