Spectrum FiehnHILIC001767 for Androsterone

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  • 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
QGXBDMJGAMFCBF-HLUDHZFRSA-N
C19H30O2
290.2245802
O=C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C
InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1

Mass Spectral Metadata

NameValue
M + 0
4.39905
15 eV
positive
405
35 eV
LC-ESI-QTOF
SCIEX TripleTOF 6600
Michael Sa and Megan Showalter
MS2
Waters Acquity UPLC BEH Amide column (2.1 x 150mm: 1.7µm)
1.6608876040723883
0.5746276753275884
291.2357
[M+H]+
10.815294965613647 ppm
0.003149800000016967 Da