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(3E,5E)-3,5-Bis(1,3-benzodioxol-5-ylmethylene)-1-propyl-4-piperidinone
SpectraBase Compound ID FmtxUa7HYy1
InChI InChI=1S/C24H23NO5/c1-2-7-25-12-18(8-16-3-5-20-22(10-16)29-14-27-20)24(26)19(13-25)9-17-4-6-21-23(11-17)30-15-28-21/h3-6,8-11H,2,7,12-15H2,1H3/b18-8-,19-9+
InChIKey BDHNDBUMWWYHMO-NCEWWTOFSA-N
Mol Weight 405.45 g/mol
Molecular Formula C24H23NO5
Exact Mass 405.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIFyzjioJgl
Name (3E,5E)-3,5-Bis(1,3-benzodioxol-5-ylmethylene)-1-propyl-4-piperidinone
CAS Registry Number 331839-37-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23NO5
InChI InChI=1S/C24H23NO5/c1-2-7-25-12-18(8-16-3-5-20-22(10-16)29-14-27-20)24(26)19(13-25)9-17-4-6-21-23(11-17)30-15-28-21/h3-6,8-11H,2,7,12-15H2,1H3/b18-8-,19-9+
InChIKey BDHNDBUMWWYHMO-NCEWWTOFSA-N
Molecular Weight 405.450 g/mol
SMILES C1Oc2c(O1)ccc(c2)\C=C/1C(\C(CN(C1)CCC)=C\c1cc2c(cc1)OCO2)=O
SPLASH splash10-052f-7920100000-8b181d90055af47fb1f5
Synonyms (3Z,5E)-3,5-bis(1,3-benzodioxol-5-ylmethylene)-1-propyl-piperidin-4-one (3Z,5E)-3,5-bis(1,3-benzodioxol-5-ylmethylidene)-1-propyl-4-piperidinone (3Z,5E)-3,5-bis(1,3-benzodioxol-5-ylmethylidene)-1-propyl-piperidin-4-one (3Z,5E)-3,5-dipiperonylidene-1-propyl-4-piperidone 3,5-Dipiperonylidene-1-propyl-4-piperidone
Wiley ID 1468187