Spectrum VF-NPL-LTQ007329 for Chrysin Dimethyl Ether

Rating: (*)★(*)★(*)★(*)☆( )☆
  • Originally submitted to the Vaniya/Fiehn Natural Products Library

Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
InChI=1S/C17H14O4/c1-19-12-8-15(20-2)17-13(18)10-14(21-16(17)9-12)11-6-4-3-5-7-11/h3-10H,1-2H3
C17H14O4
282.089208928
O=C1C=C(OC2=CC(OC)=CC(OC)=C12)C=3C=CC=CC3
JRFZSUMZAUHNSL-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
35
NP_C4_8_p5_E09_iTree_POS_62.RAW
positive
Linear Ion Trap
Thermo Finnigan LTQ
Arpana Vaniya
direct infusion
3.50 kV
275 C
ESI Ion Max
0.0
NaN
283.15624281939336
M+H
208.59116791934298 ppm
0.05906389139335033 Da