Spectrum CCMSLIB00000424786 for Pilocarpine

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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
92-13-7
InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3
C11H16N2O2
208.121177752
O=C1OCC(CC2=CN=CN2C)C1CC
QCHFTSOMWOSFHM-UHFFFAOYSA-N

Mass Spectral Metadata

NameValue
DI-ESI
Commercial
qTof
208.121
1
f.10mauriz/16_br_pos_40_eV.mgf;
MS2
GNPS-LIBRARY
Lucas Marques, 10mauriz, Norberto Lopes
positive
2.9576071872201872
0.7560301110490264
209.128
[M+H]+
5.488275123410041 ppm
-0.001147752000008495 Da