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4H-1,3-Benzodioxin-4-one, hexahydro-4a-(2-propenyl)-, (4aS-cis)-
SpectraBase Compound ID EoAWcPCBe3V
InChI InChI=1S/C11H16O3/c1-2-6-11-7-4-3-5-9(11)13-8-14-10(11)12/h2,9H,1,3-8H2/t9-,11?/m0/s1
InChIKey MATBJOSZNZZTPC-FTNKSUMCSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeJ3kHsjTFx
Name 4H-1,3-Benzodioxin-4-one, hexahydro-4a-(2-propenyl)-, (4aS-cis)-
Alternate Name(s) (4S,8aS)-4a-allyl-perhydro-2H,4H-[1,3]benzodioxin-4-one (8aS)-4a-allylhexahydro-4H-1,3-benzodioxin-4-one
CAS Registry Number 124899-02-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-2-6-11-7-4-3-5-9(11)13-8-14-10(11)12/h2,9H,1,3-8H2/t9-,11?/m0/s1
InChIKey MATBJOSZNZZTPC-FTNKSUMCSA-N
Molecular Weight 196.246 g/mol
SMILES C12(C(OCO[C@]2(CCCC1)[H])=O)CC=C
SPLASH splash10-003u-9200000000-81974ee8b60f5a91294d
Source of Spectrum H-72-704-6
Wiley ID 1193171