CID 3074327

2-morpholino-2,3-dihydro-1,3,2-benzoxazaphosphorin-4-one 2-oxide

Structural Information

Molecular Formula
C11H13N2O4P
SMILES
C1COCCN1P2(=O)NC(=O)C3=CC=CC=C3O2
InChI
InChI=1S/C11H13N2O4P/c14-11-9-3-1-2-4-10(9)17-18(15,12-11)13-5-7-16-8-6-13/h1-4H,5-8H2,(H,12,14,15)
InChIKey
OMDWCUDYZMVYPM-UHFFFAOYSA-N
Compound name
2-morpholin-4-yl-2-oxo-3H-1,3,2lambda5-benzoxazaphosphinin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.06128 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.06856 159.4
[M+Na]+ 291.05050 165.5
[M-H]- 267.05400 162.1
[M+NH4]+ 286.09510 172.3
[M+K]+ 307.02444 164.9
[M+H-H2O]+ 251.05854 148.0
[M+HCOO]- 313.05948 177.2
[M+CH3COO]- 327.07513 191.6
[M+Na-2H]- 289.03595 163.1
[M]+ 268.06073 155.5
[M]- 268.06183 155.5
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.