Spectrum FiehnHILIC000547 for N-2-Fluorenylacetamide

Rating: (*)★(*)★(*)★(*)★(*)★
  • Originally submitted to the Fiehn Lab HILIC 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
CZIHNRWJTSTCEX-UHFFFAOYSA-N
C15H13NO
223.099714036
OC(=NC1=CC=C2C=3C=CC=CC3CC2=C1)C
InChI=1S/C15H13NO/c1-10(17)16-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9H,8H2,1H3,(H,16,17)

Mass Spectral Metadata

NameValue
M + 0
841
positive
HCD (NCE 20-30-40%)
4.744117
LC-ESI-QFT
Thermo Q Exactive HF
Michael Sa and Megan Showalter
MS2
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm)
2.2949574019511556
0.6963200835645186
224.1028
[M+H]+
21.793730377277193 ppm
-0.004884035999992875 Da