CID 76006

Benzyl diethyl phosphite

Structural Information

Molecular Formula
C11H17O3P
SMILES
CCOP(OCC)OCC1=CC=CC=C1
InChI
InChI=1S/C11H17O3P/c1-3-12-15(13-4-2)14-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKey
ATRSPWZERUQFPN-UHFFFAOYSA-N
Compound name
benzyl diethyl phosphite
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

217
Patents

228.09154 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.09882 154.4
[M+Na]+ 251.08076 159.9
[M-H]- 227.08426 156.2
[M+NH4]+ 246.12536 172.8
[M+K]+ 267.05470 159.4
[M+H-H2O]+ 211.08880 145.3
[M+HCOO]- 273.08974 183.0
[M+CH3COO]- 287.10539 191.3
[M+Na-2H]- 249.06621 156.1
[M]+ 228.09099 160.1
[M]- 228.09209 160.1
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