Spectrum MoNA001812 for ARGININE

Rating: (*)★(*)★(*)★(*)★(*)☆

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/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1
ODKSFYDXXFIFQN-BYPYZUCNSA-N
C6H14N4O2
174.111675688
O=C(O)C(N)CCCNC(=N)N

Mass Spectral Metadata

NameValue
MS2
LC-ESI-QTOF
Agilent QTOF 6550
10
C6H14N4O2
174.111679
174.111679
qtof_library_rp_pos_proton_sept_2018_dinesh_barupal.msp
positive
1.96794626196262
0.5371675031158949
175.119741821289
[M+H]+
0.5489574620205989 ppm
9.613328901991736E-5 Da