CID 135666383

Aldehydo-d-ribose (4-oxo-6-phenylpyriidin-2-yl)hydrazone

Structural Information

Molecular Formula
C15H18N4O5
SMILES
C1=CC=C(C=C1)C2=CC(=O)NC(=N2)N/N=C/[C@H]([C@H]([C@H](CO)O)O)O
InChI
InChI=1S/C15H18N4O5/c20-8-12(22)14(24)11(21)7-16-19-15-17-10(6-13(23)18-15)9-4-2-1-3-5-9/h1-7,11-12,14,20-22,24H,8H2,(H2,17,18,19,23)/b16-7+/t11-,12+,14-/m1/s1
InChIKey
DLRRVRIOIMAUCY-REHOSBKUSA-N
Compound name
4-phenyl-2-[(2E)-2-[(2R,3R,4S)-2,3,4,5-tetrahydroxypentylidene]hydrazinyl]-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

334.12772 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.13500 173.6
[M+Na]+ 357.11694 177.0
[M-H]- 333.12044 172.5
[M+NH4]+ 352.16154 180.4
[M+K]+ 373.09088 173.1
[M+H-H2O]+ 317.12498 164.4
[M+HCOO]- 379.12592 189.4
[M+CH3COO]- 393.14157 205.6
[M+Na-2H]- 355.10239 175.9
[M]+ 334.12717 169.8
[M]- 334.12827 169.8
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

No patent data available for this compound.