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1,4,6-Trimethyl-3,7,9-trioxabicyclo[4.2.1]nonane
SpectraBase Compound ID 2T21VhwRE4H
InChI InChI=1S/C9H16O3/c1-7-4-9(3)11-6-8(2,12-9)5-10-7/h7H,4-6H2,1-3H3/t7?,8-,9+/m1/s1
InChIKey HJEVEYGMLWUGKM-ASODMVGOSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUJWDwfFWpH
Name 1,4,6-Trimethyl-3,7,9-trioxabicyclo[4.2.1]nonane
Alternate Name(s) 1,3,6-trimethyl-4,8,9-trioxabicyclo[4.2.1]nonane trans-1,4,6-Trimethyl-3,7,9-trioxabicyclo(4,2,0)nonane
CAS Registry Number 62759-58-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-7-4-9(3)11-6-8(2,12-9)5-10-7/h7H,4-6H2,1-3H3/t7?,8-,9+/m1/s1
InChIKey HJEVEYGMLWUGKM-ASODMVGOSA-N
Molecular Weight 172.224 g/mol
SMILES [C@]12(O[C@](OC2)(CC(OC1)C)C)C
SPLASH splash10-0006-9100000000-bc283a4fbececca8bb80
Source of Spectrum O-11-1040-1
Wiley ID 1168719