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3,3-di-2-buten-1-yl-6-methyl-2,4-pyrandione
SpectraBase Compound ID LJHLDkIXULG
InChI InChI=1S/C14H18O3/c1-4-6-8-14(9-7-5-2)12(15)10-11(3)17-13(14)16/h4-7,10H,8-9H2,1-3H3/b6-4+,7-5+
InChIKey YIWZIXNYHNEJKW-YDFGWWAZSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELpxVuWpgvo
Name 3,3-di-2-buten-1-yl-6-methyl-2,4-pyrandione
CAS Registry Number 115580-48-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-4-6-8-14(9-7-5-2)12(15)10-11(3)17-13(14)16/h4-7,10H,8-9H2,1-3H3/b6-4+,7-5+
InChIKey YIWZIXNYHNEJKW-YDFGWWAZSA-N
Molecular Weight 234.295 g/mol
SMILES C1(C(OC(=CC1=O)C)=O)(C\C=C\C)C\C=C\C
SPLASH splash10-004i-0910000000-76a14c15c324e8a05150
Source of Spectrum J-53-5334-4
Synonyms 3,3-di[(2E)-2-butenyl]-6-methyl-2H-pyran-2,4(3H)-dione
Wiley ID 1236137