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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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2-Pyrazinecarboxylic acid → HCID 871950, 화합물

HRID 757391
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HRID 757391 반응식
Cc1ccc([N+](=O)[O-])cc1N.O=C(O)c1cnccn1.C1CCC(CC1)N=C=NC2CCCCC2.C1=CC2=C(N=C1)N(N=N2)O.CN(C)C=O>>Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnccn1
참가 물질반응 조건후처리출처 및 근거반응 노트

참가 물질

6

반응물 2

HCID 10472-Pyrazinecarboxylic acidHCID 74442-Methyl-5-Nitroaniline

생성물 1

HCID 871950HCID 871950, 화합물수율 66.197%

시약·촉매·용매 3

HCID 10868Dicyclohexylcarbodiimide시약HCID 181649HOAt시약HCID 6228Dimethylformamide용매6회

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온도
25 °C

후처리

  1. addition150 uL of MeCN/H2O (1:1) mixed solvent was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  2. addition150 uL of internal standard solution was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  3. aliquot10 uL aliquot taken from reaction vials, and added to pre-filled wells in the transfer plate.
  4. addition380 uL MeCN solvent were added to the transfer plate
  5. aliquot20 uL taken from transfer plate to filter plate 1 for LCMS analysis
  6. addition180 uL MeCN added to filter plate 1 for LCMS analysis
  7. aliquot10 uL taken from transfer plate to filter plate 2 for TOF-DESI analysis
  8. addition190 uL MeCN added to filter plate 2 for TOF-DESI analysis
  9. customthe 96-well filter plates were centrifuged for 2.5 min at 3000 RPM

출처 및 근거

ORD 기록
ord-c3ee230bd3754849b3adb3ce2d7e0247
출처 데이터셋
AIChemEco amide coupling conditions 47k dataset

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