CID 371428

Benzamide riboside monophosphate

Structural Information

Molecular Formula
C12H16NO8P
SMILES
C1=CC(=CC(=C1)C(=O)N)C2C(C(C(O2)COP(=O)(O)O)O)O
InChI
InChI=1S/C12H16NO8P/c13-12(16)7-3-1-2-6(4-7)11-10(15)9(14)8(21-11)5-20-22(17,18)19/h1-4,8-11,14-15H,5H2,(H2,13,16)(H2,17,18,19)
InChIKey
QTPHDABYULBTRC-UHFFFAOYSA-N
Compound name
[5-(3-carbamoylphenyl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.06134 Da
Monoisotopic Mass

-2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.06862 170.4
[M+Na]+ 356.05056 174.9
[M-H]- 332.05406 171.1
[M+NH4]+ 351.09516 181.3
[M+K]+ 372.02450 174.6
[M+H-H2O]+ 316.05860 162.3
[M+HCOO]- 378.05954 190.7
[M+CH3COO]- 392.07519 201.7
[M+Na-2H]- 354.03601 168.6
[M]+ 333.06079 169.5
[M]- 333.06189 169.5
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.