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2-Hexynyl-4-hydroxy-3-methoxy-4-(2-propenyl)-2-cyclobuten-1-one
SpectraBase Compound ID 28HypHgkkQK
InChI InChI=1S/C14H18O3/c1-4-6-7-8-9-11-12(15)14(16,10-5-2)13(11)17-3/h5,16H,2,4,6,9-10H2,1,3H3
InChIKey NCCAWRAXNHXWNI-UHFFFAOYSA-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 Bd3dYvyXsrL
Name 2-Hexynyl-4-hydroxy-3-methoxy-4-(2-propenyl)-2-cyclobuten-1-one
Alternate Name(s) 4-Allyl-2-(2-hexynyl)-4-hydroxy-3-methoxy-2-cyclobuten-1-one
CAS Registry Number 124022-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-4-6-7-8-9-11-12(15)14(16,10-5-2)13(11)17-3/h5,16H,2,4,6,9-10H2,1,3H3
InChIKey NCCAWRAXNHXWNI-UHFFFAOYSA-N
Molecular Weight 234.295 g/mol
SMILES OC1(C(OC)=C(C1=O)CC#CCCC)CC=C
SPLASH splash10-002f-6910000000-80712b475c8c911af32a
Source of Spectrum J-56-6099-16
Wiley ID 1236169