CID 102878

2783-48-4

Structural Information

Molecular Formula
C14H23O3P
SMILES
CCC(C)OP(=O)(C1=CC=CC=C1)OC(C)CC
InChI
InChI=1S/C14H23O3P/c1-5-12(3)16-18(15,17-13(4)6-2)14-10-8-7-9-11-14/h7-13H,5-6H2,1-4H3
InChIKey
LVHRUHVOYXWOMW-UHFFFAOYSA-N
Compound name
di(butan-2-yloxy)phosphorylbenzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

21
Patents

270.1385 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.14578 167.7
[M+Na]+ 293.12772 172.5
[M-H]- 269.13122 169.4
[M+NH4]+ 288.17232 184.5
[M+K]+ 309.10166 171.6
[M+H-H2O]+ 253.13576 158.9
[M+HCOO]- 315.13670 193.0
[M+CH3COO]- 329.15235 200.6
[M+Na-2H]- 291.11317 167.6
[M]+ 270.13795 172.8
[M]- 270.13905 172.8
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

patents stripe