Spectrum KNA00569 for Hypoxanthine

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

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Compound Metadata

NameValue
Natural Product
InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)
FDGQSTZJBFJUBT-UHFFFAOYSA-N
C5H4N4O
136.038510748
OC1=NC=NC=2NC=NC12

Mass Spectral Metadata

NameValue
35eV
KNA00569
2016.01.19 (Created 2009.11.18, modified 2011.08.03)
Takahashi H, Kanaya S, Ogasawara N, Graduate School of Information Science, NAIST
CC BY-SA
[Spectral] Hypoxanthine (exact mass = 136.03851) and Adenine (exact mass = 135.0545) were not completely separated on HPLC under the present analytical conditions as described in "AC$XXX". Additionally some of the peaks in this data contains dimers and other unidentified ions.
136.03851
LTQ Orbitrap XL, Thermo Scientfic
LC-ESI-ITFT
MS1
ESI
TOSOH TSKgel ODS-100V 5um Part no. 21456
0min:3%, 45min:97%, 50min:97%, 50.1:3%, 57min:3% (acetonitrile)
0.5 ml/min
5.484573 min
0.1%formate-water / 0.1%formate-acetonitrile
negative
4.240864583186326
0.6641715691306138