Spectrum PR010038 for L-Tyrosine

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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
Natural Product
InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
OUYCCCASQSFEME-QMMMGPOBSA-N
C9H11NO3
181.07389321199997
O=C(O)C(N)CC1=CC=C(O)C=C1

Mass Spectral Metadata

NameValue
PR010038
2016.01.19 (Created 2006.12.21, modified 2011.05.06)
Kusano M, Fukushima A, Plant Science Center, RIKEN.
CC BY-SA
181.07389
Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
GC-EI-TOF
MS1
1932.3
469.708 sec
C18H35NO3Si3
397.19247
3 TMS
ChromaTOF ver. 2.32 (Leco)
positive
2.743174984020444
0.5681434830606356