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(7R)-2-(tert-butyl)-4,7-dimethylhexahydro-4H-benzo[d][1,3]dioxine
SpectraBase Compound ID H864hLJPLnN
InChI InChI=1S/C14H26O2/c1-9-6-7-11-10(2)15-13(14(3,4)5)16-12(11)8-9/h9-13H,6-8H2,1-5H3/t9-,10?,11?,12?,13?/m1/s1
InChIKey XDMMPFNBDAZKQA-HIVKSXORSA-N
Mol Weight 226.36 g/mol
Molecular Formula C14H26O2
Exact Mass 226.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmadHX79xIN
Name (7R)-2-(tert-butyl)-4,7-dimethylhexahydro-4H-benzo[d][1,3]dioxine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O2
InChI InChI=1S/C14H26O2/c1-9-6-7-11-10(2)15-13(14(3,4)5)16-12(11)8-9/h9-13H,6-8H2,1-5H3/t9-,10?,11?,12?,13?/m1/s1
InChIKey XDMMPFNBDAZKQA-HIVKSXORSA-N
Ionization Type EI
Molecular Weight 226.360 g/mol
SMILES C(C1OC(C2C(O1)C[C@@](CC2)(C)[H])C)(C)(C)C
SPLASH splash10-01c0-9700000000-4cda2c1c45c19f0a6104
Sample Comments Minor isomer
Source of Spectrum US20210198229A1
Wiley ID 1879970