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1-Methyl-5-oxa-9-(1,2-epoxy-isopropyl)-bicyclo[5.4.0]undecan-6-en-4-one
SpectraBase Compound ID DTPAVUb3sQj
InChI InChI=1S/C14H20O3/c1-13-5-3-10(14(2)9-17-14)7-11(13)8-16-12(15)4-6-13/h8,10H,3-7,9H2,1-2H3
InChIKey APDCFFJGVGPGNW-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID adw04rcv9z
Name 1-Methyl-5-oxa-9-(1,2-epoxy-isopropyl)-bicyclo[5.4.0]undecan-6-en-4-one
Alternate Name(s) 5a-methyl-8-(2-methyl-2-oxiranyl)-5,5a,6,7,8,9-hexahydro-2-benzoxepin-3(4H)-one
CAS Registry Number 93860-83-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-13-5-3-10(14(2)9-17-14)7-11(13)8-16-12(15)4-6-13/h8,10H,3-7,9H2,1-2H3
InChIKey APDCFFJGVGPGNW-UHFFFAOYSA-N
Molecular Weight 236.311 g/mol
SMILES C1(OC1)(C1CC2=COC(=O)CCC2(CC1)C)C
SPLASH splash10-0a4i-0790000000-babb6e0439bdf389037c
Source of Spectrum J-50-259-15
Wiley ID 1238400