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(3R*,4R*)-4-Allyl-3-hydroxy-1-cycloheptanone
SpectraBase Compound ID E1I80asv7Et
InChI InChI=1S/C10H16O2/c1-2-4-8-5-3-6-9(11)7-10(8)12/h2,8,10,12H,1,3-7H2/t8-,10+/m0/s1
InChIKey KYLDVKUGTWMBDV-WCBMZHEXSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cu2trSWjLq
Name (3R*,4R*)-4-Allyl-3-hydroxy-1-cycloheptanone
Alternate Name(s) (3R,4R)-4-allyl-3-hydroxycycloheptanone (3S*,4S*)-4-Allyl-3-hydroxy-1-cycloheptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-2-4-8-5-3-6-9(11)7-10(8)12/h2,8,10,12H,1,3-7H2/t8-,10+/m0/s1
InChIKey KYLDVKUGTWMBDV-WCBMZHEXSA-N
Molecular Weight 168.236 g/mol
SMILES O[C@@]1(CC(=O)CCC[C@@]1(CC=C)[H])[H]
SPLASH splash10-0006-9000000000-a11ff01f2e819e396953
Source of Spectrum QF-10-865-26
Wiley ID 1559246