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5-Methoxy-2-oxatricyclo[6.4.0.0(1,6)]undec-4-en-3-one
SpectraBase Compound ID KLgUPcVTfSJ
InChI InChI=1S/C12H16O3/c1-14-10-7-11(13)15-12-5-3-2-4-8(12)6-9(10)12/h7-9H,2-6H2,1H3
InChIKey GAKVSFWENCQLQY-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKfIZkJRler
Name 5-Methoxy-2-oxatricyclo[6.4.0.0(1,6)]undec-4-en-3-one
Alternate Name(s) 4-methoxy-5,5a,6,7,8,9-hexahydrobenzo[4,1]cyclobuta[1,2-b]pyran-2(4aH)-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-14-10-7-11(13)15-12-5-3-2-4-8(12)6-9(10)12/h7-9H,2-6H2,1H3
InChIKey GAKVSFWENCQLQY-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C123C(C(OC)=CC(O3)=O)CC1CCCC2
SPLASH splash10-004i-0900000000-55bc6366b27b9465e79a
Source of Spectrum Y-31-390-11
Wiley ID 761384