CID 10978723

19236-58-9

Structural Information

Molecular Formula
C15H17O3P
SMILES
CP(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2
InChI
InChI=1S/C15H17O3P/c1-19(16,17-12-14-8-4-2-5-9-14)18-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKey
BPYBCKBGKAIOBH-UHFFFAOYSA-N
Compound name
[methyl(phenylmethoxy)phosphoryl]oxymethylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

501
Patents

276.09152 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.09880 165.1
[M+Na]+ 299.08074 171.1
[M-H]- 275.08424 170.1
[M+NH4]+ 294.12534 181.1
[M+K]+ 315.05468 168.4
[M+H-H2O]+ 259.08878 155.0
[M+HCOO]- 321.08972 193.3
[M+CH3COO]- 335.10537 197.7
[M+Na-2H]- 297.06619 169.1
[M]+ 276.09097 168.6
[M]- 276.09207 168.6
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