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(1R,5R)-1-Allyl-5-but-2-enyl-6-oxabicyclo[3.1,0]hexan-2-one
SpectraBase Compound ID 4B29N92fX52
InChI InChI=1S/C12H16O2/c1-3-5-8-11-9-6-10(13)12(11,14-11)7-4-2/h3-4H,1-2,5-9H2/t11-,12+/m1/s1
InChIKey JCPZHJARKQJDBW-NEPJUHHUSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HR32018TtLG
Name (1R,5R)-1-Allyl-5-but-2-enyl-6-oxabicyclo[3.1,0]hexan-2-one
Comments Removed - expert review: solvent contamination (chloroform)); A corrected record has been addded having SpectrumID: 1718194
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-3-5-8-11-9-6-10(13)12(11,14-11)7-4-2/h3-4H,1-2,5-9H2/t11-,12+/m1/s1
InChIKey JCPZHJARKQJDBW-NEPJUHHUSA-N
Molecular Weight 192.258 g/mol
SMILES [C@@]12(O[C@@]2(CCC1=O)CCC=C)CC=C
SPLASH splash10-001i-9100000000-7c4433d1aa186fa8cb07
Source of Spectrum F-51-13011-15
Synonyms (1R,5R)-1-allyl-5-(3-butenyl)-6-oxabicyclo[3.1.0]hexan-2-one (1R,5R)-1-but-3-enyl-5-prop-2-enyl-6-oxabicyclo[3.1.0]hexan-4-one (1R,5R)-5-allyl-1-but-3-enyl-6-oxabicyclo[3.1.0]hexan-4-one 1-Allyl-3-but-2-enyl-6-oxabicyclo[3.1,0]hexan-2-one (1R,5R)-5-but-3-enyl-1-prop-2-enyl-6-oxabicyclo[3.1.0]hexan-2-one
Wiley ID 794390