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1,2,2&apos;-Triferuloylgentiobiose
  Mrv2104 06072104232D

62 66  0  0  1  0            999 V2000
    3.5724   -4.6706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.0013   -3.0206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -3.4331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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 59 60  1  0  0  0  0
 57 58  1  0  0  0  0
 42 43  1  0  0  0  0
M  END

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(+)-Catechin
  Mrv1572001071604202D

21 23  0  0  1  0            999 V2000
    2.0414   -2.6714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -2.2589    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6125   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -3.4964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2454   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6125   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1848   -1.4339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END

Results 1 — 16 of approximately 16 results

PHUB000507 Score: 1.0	1,2,2'-Triferuloylgentiobiose precursor	C₄₂H₄₆O₂₀ Mono mass: 870.258243881
PHUB000509 Score: 1.0	1,2-Diferuloylgentiobiose precursor	C₃₂H₃₈O₁₇ Mono mass: 694.210899764
PHUB000508 Score: 0.975	1,2,2'-Trisinapoylgentiobiose precursor	C₄₅H₅₂O₂₃ Mono mass: 960.289937934
PHUB000510 Score: 0.975	1,2'-Disinapoyl-2-feruloylgentiobiose precursor	C₄₄H₅₀O₂₂ Mono mass: 930.27937325
PHUB000511 Score: 0.975	1,2-Disinapoylgentiobiose precursor	C₃₄H₄₂O₁₉ Mono mass: 754.232029132
PHUB000515 Score: 0.975	1-Sinapoyl-2,2'-diferuloylgentiobiose precursor	C₄₃H₄₈O₂₁ Mono mass: 900.268808566
PHUB000516 Score: 0.975	1-Sinapoyl-2-feruloylgentiobiose precursor	C₃₃H₄₀O₁₈ Mono mass: 724.221464448
PHUB000578 Score: 0.904	Caffeoyl glucose precursor	C₁₅H₁₈O₉ Mono mass: 342.09508216
PHUB000610 Score: 0.904	Feruloyl glucose precursor	C₁₆H₂₀O₉ Mono mass: 356.110732224
PHUB000593 Score: 0.854	Coumaroyl glucose (p-) precursor	C₁₅H₁₈O₈ Mono mass: 326.10016754
PHUB001430 Score: 0.848	Sinapic acid O-glucuronide metabolite	C₁₇H₂₀O₁₁ Mono mass: 400.100561464
PHUB000646 Score: 0.822	Verbascoside 61276-17-3 precursor	C₂₉H₃₆O₁₅ Mono mass: 624.205420459
PHUB002476 Score: 0.791	5-Feruloylquinic acid-4'-glucuronide metabolite	C₂₃H₂₈O₁₅ Mono mass: 544.142820202
PHUB000587 Score: 0.745	Cinnamoyl glucose precursor	C₁₅H₁₈O₇ Mono mass: 310.10525292
PHUB002059 Score: 0.716	Paniculoside VI precursor	C₃₅H₄₆O₁₁ Mono mass: 642.304012301
PHUB000526 Score: 0.701	3,4-Diferuloylquinic acid precursor	C₂₇H₂₈O₁₂ Mono mass: 544.158076342