CID 60239

108331-12-0

Structural Information

Molecular Formula
C11H23O4P
SMILES
CCCCCOP1(=O)C(CC(O1)(C)C)(C)O
InChI
InChI=1S/C11H23O4P/c1-5-6-7-8-14-16(13)11(4,12)9-10(2,3)15-16/h12H,5-9H2,1-4H3
InChIKey
VHSRTSZDSBGHSJ-UHFFFAOYSA-N
Compound name
3,5,5-trimethyl-2-oxo-2-pentoxy-1,2lambda5-oxaphospholan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.13339 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.14067 151.4
[M+Na]+ 273.12261 159.6
[M-H]- 249.12611 153.5
[M+NH4]+ 268.16721 175.4
[M+K]+ 289.09655 159.8
[M+H-H2O]+ 233.13065 147.3
[M+HCOO]- 295.13159 176.8
[M+CH3COO]- 309.14724 191.3
[M+Na-2H]- 271.10806 155.2
[M]+ 250.13284 157.3
[M]- 250.13394 157.3
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.