CID 22121380

26088-25-5

Structural Information

Molecular Formula
C10H17O3P
SMILES
CC12CC3(OC(O1)(CC(O2)(P3)C)C)C
InChI
InChI=1S/C10H17O3P/c1-7-5-9(3)13-8(2,11-7)6-10(4,12-7)14-9/h14H,5-6H2,1-4H3
InChIKey
DSYQHWPNJZFRCU-UHFFFAOYSA-N
Compound name
1,3,5,7-tetramethyl-2,4,6-trioxa-8-phosphatricyclo[3.3.1.13,7]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

154
Patents

216.09154 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.09882 148.3
[M+Na]+ 239.08076 154.9
[M-H]- 215.08426 145.9
[M+NH4]+ 234.12536 176.0
[M+K]+ 255.05470 156.4
[M+H-H2O]+ 199.08880 138.8
[M+HCOO]- 261.08974 158.5
[M+CH3COO]- 275.10539 159.0
[M+Na-2H]- 237.06621 161.4
[M]+ 216.09099 155.1
[M]- 216.09209 155.1
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

patents stripe