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2-[(5Z,8Z,11Z)-heptadeca-5,8,11-trienyl]-2,3-dihydropyran-6-one
SpectraBase Compound ID IK4rkvIJfRz
InChI InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(23)24-21/h6-7,9-10,12-13,17,20-21H,2-5,8,11,14-16,18-19H2,1H3/b7-6-,10-9-,13-12-
InChIKey NSHWWXNBJYFANB-QNEBEIHSSA-N
Mol Weight 330.5 g/mol
Molecular Formula C22H34O2
Exact Mass 330.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PR4Me9G6Su
Name 2-[(5Z,8Z,11Z)-heptadeca-5,8,11-trienyl]-2,3-dihydropyran-6-one
CAS Registry Number 81575-28-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(23)24-21/h6-7,9-10,12-13,17,20-21H,2-5,8,11,14-16,18-19H2,1H3/b7-6-,10-9-,13-12-
InChIKey NSHWWXNBJYFANB-QNEBEIHSSA-N
Molecular Weight 330.512 g/mol
SMILES C1(OC(CCCC\C=C/C\C=C/C\C=C/CCCCC)CC=C1)=O
SPLASH splash10-0532-3910000000-560b22726cede616c690
Source of Spectrum B-35-119-0
Wiley ID 1328337