Pipernonaline

Pipernonaline

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Catalog Number ACM88660100
CAS Number 88660-10-0
Synonyms Piperidine,1-[(2E,8E)-9-(1,3-benzodioxol-5-yl)-1-oxo-2,8-nonadienyl]-
IUPAC Name (2E,8E)-9-(1,3-Benzodioxol-5-yl)-1-piperidin-1-ylnona-2,8-dien-1-one
Molecular Weight 341.44
Molecular Formula C21H27NO3
Canonical SMILES C1CCN(CC1)C(=O)C=CCCCCC=CC2=CC3=C(C=C2)OCO3
InChI InChI=1S/C21H27NO3/c23-21(22-14-8-5-9-15-22)11-7-4-2-1-3-6-10-18-12-13-19-20(16-18)25-17-24-19/h6-7,10-13,16H,1-5,8-9,14-15,17H2/b10-6+,11-7+
InChI Key PKLGRWSJBLGIBF-JMQWPVDRSA-N
Purity 98%+ (HPLC)
Storage Store in dry, low temperature, sealed, 2-8 °C.
Complexity 468
Exact Mass 341.19909372
Heavy Atom Count 25
Isomeric SMILES C1CCN(CC1)C(=O)/C=C/CCCC/C=C/C2=CC3=C(C=C2)OCO3
Monoisotopic Mass 341.19909372
Topological Polar Surface Area 38.8Ų

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