CID 55532

Cis-2-methoxy-3,5,5-trimethyl-1,2-oxaphospholan-3-ol 2-oxide

Structural Information

Molecular Formula
C7H15O4P
SMILES
CC1(CC(P(=O)(O1)OC)(C)O)C
InChI
InChI=1S/C7H15O4P/c1-6(2)5-7(3,8)12(9,10-4)11-6/h8H,5H2,1-4H3
InChIKey
WGXMDGUEJDELPK-UHFFFAOYSA-N
Compound name
2-methoxy-3,5,5-trimethyl-2-oxo-1,2lambda5-oxaphospholan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.0708 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.07808 133.0
[M+Na]+ 217.06002 142.9
[M-H]- 193.06352 135.7
[M+NH4]+ 212.10462 159.1
[M+K]+ 233.03396 143.9
[M+H-H2O]+ 177.06806 129.6
[M+HCOO]- 239.06900 159.7
[M+CH3COO]- 253.08465 179.4
[M+Na-2H]- 215.04547 138.8
[M]+ 194.07025 137.4
[M]- 194.07135 137.4
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

No patent data available for this compound.