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]+ 223.10938 142.2
[M+Na]+ 245.09132 151.3
[M-H]- 221.09482 144.6
[M+NH4]+ 240.13592 167.3
[M+K]+ 261.06526 151.9
[M+H-H2O]+ 205.09936 138.5
[M+HCOO]- 267.10030 168.3
[M+CH3COO]- 281.11595 185.4
[M+Na-2H]- 243.07677 147.1
[M]+ 222.10155 147.4
[M]- 222.10265 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.