Spectrum KO009057 for Methoxamine

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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
InChI=1S/C11H17NO3/c1-7(12)11(13)9-6-8(14-2)4-5-10(9)15-3/h4-7,11,13H,12H2,1-3H3
WJAJPNHVVFWKKL-UHFFFAOYSA-N
C11H17NO3
211.120843404
OC(C1=CC(OC)=CC=C1OC)C(N)C

Mass Spectral Metadata

NameValue
KO009057
2011.12.05 (Created 2008.05.12)
Ojima Y, Kakazu Y, Horai H, Soga T, Institute for Advanced Biosciences, Keio Univ.
CC BY-NC-SA
211.12084
LC/MSD Trap XCT, Agilent Technologies
LC-ESI-IT
MS3
0.60/0.60
LC/MSD Trap Control and Data Analysis
positive
212/194
[M+H]+
2.209147609721355
0.7374315886714836
194.0
[M+H]+
93447.49177319587 ppm
-18.128813404 Da