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Amb25712944

Duplicate ID
Molecule Name 2-Buten-1-one,1-(3-pyridinyl)-, (E)- (9CI)
100021-45-2
SmilesC/C=C/C(=O)c1ccc[n]c1
InchiKeyZXESZGKRPDKHDW-DUXPYHPUSA-N
InChi InChI=1S/C9H9NO/c1-2-4-9(11)8-5-3-6-10-7-8/h2-7H,1H3/b4-2+
Formula C9H9NO
Molecular weight 147.174
Rings 1
logP 1.8404
PSA 29.96
MR 43.5715
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