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7-(Isovaleryloxy)-10-(isobutyryloxy)-8,9-dihydro-8,9-epoxythymol - Isobutyrate
SpectraBase Compound ID KWUTu306qLM
InChI InChI=1S/C23H32O7/c1-14(2)9-20(24)27-11-17-7-8-18(19(10-17)30-22(26)16(5)6)23(13-29-23)12-28-21(25)15(3)4/h7-8,10,14-16H,9,11-13H2,1-6H3
InChIKey XERRCUMMXNJCFB-UHFFFAOYSA-N
Mol Weight 420.5 g/mol
Molecular Formula C23H32O7
Exact Mass 420.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Azj4utj7U7U
Name 7-(Isovaleryloxy)-10-(isobutyryloxy)-8,9-dihydro-8,9-epoxythymol - Isobutyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O7
InChI InChI=1S/C23H32O7/c1-14(2)9-20(24)27-11-17-7-8-18(19(10-17)30-22(26)16(5)6)23(13-29-23)12-28-21(25)15(3)4/h7-8,10,14-16H,9,11-13H2,1-6H3
InChIKey XERRCUMMXNJCFB-UHFFFAOYSA-N
Molecular Weight 420.502 g/mol
SMILES C1(OC1)(c1c(OC(=O)C(C)C)cc(cc1)COC(=O)CC(C)C)COC(=O)C(C)C
SPLASH splash10-014i-0009100000-0c6c6fe52f8869bb9afc
Source of Spectrum X2-55-826-3
Wiley ID 1604469