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8-(Benzoyloxy)-2-methyl-13-oxatricyclo[7.3.2.0(3,8)]tetradecan-14-one
SpectraBase Compound ID 3s2pFDJSJbb
InChI InChI=1S/C21H26O4/c1-14-16-10-5-6-13-21(16,17-11-7-12-18(14)24-20(17)23)25-19(22)15-8-3-2-4-9-15/h2-4,8-9,14,16-18H,5-7,10-13H2,1H3/t14?,16?,17-,18-,21?/m0/s1
InChIKey ZXNBSBACVXETOO-AGBRKFEXSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aNZAHCyW1p
Name 8-(Benzoyloxy)-2-methyl-13-oxatricyclo[7.3.2.0(3,8)]tetradecan-14-one
Alternate Name(s) 8-Methyl-13-oxo-14-oxatricyclo[7.3.2.0(2,7)]tetradec-2-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-14-16-10-5-6-13-21(16,17-11-7-12-18(14)24-20(17)23)25-19(22)15-8-3-2-4-9-15/h2-4,8-9,14,16-18H,5-7,10-13H2,1H3/t14?,16?,17-,18-,21?/m0/s1
InChIKey ZXNBSBACVXETOO-AGBRKFEXSA-N
Molecular Weight 342.435 g/mol
SMILES [C@]12(C(C3CCCCC3([C@@](CCC1)(C(O2)=O)[H])OC(c1ccccc1)=O)C)[H]
SPLASH splash10-0a4i-9710000000-7eee8e99c33a5ec638c6
Source of Spectrum D8-323-129-9
Wiley ID 1513569