CID 439246

Naringenin

Structural Information

Molecular Formula
C15H12O5
SMILES
C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O
InChI
InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1
InChIKey
FTVWIRXFELQLPI-ZDUSSCGKSA-N
Compound name
(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

2565
References

21115
Patents

272.06848 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.075756 157.5
[M+Na]+ 295.057698 166.3
[M-H]- 271.061204 162.7
[M+NH4]+ 290.102303 171.7
[M+K]+ 311.031638 163.1
[M+H-H2O]+ 255.065740 150.7
[M+HCOO]- 317.066681 174.1
[M+CH3COO]- 331.082331 192.4
[M+Na-2H]- 293.043146 162.4
[M]+ 272.06793142 156.7
[M]- 272.06902858 156.7
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