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2-(Methoxycarbonyl)-1,3-dimethyl-9-oxabicyclo[3.3.1]non-3-one
SpectraBase Compound ID 5vPncNbl2tZ
InChI InChI=1S/C12H18O4/c1-11-5-4-6-12(2,16-11)9(8(13)7-11)10(14)15-3/h9H,4-7H2,1-3H3/t9-,11+,12-/m0/s1
InChIKey WYBANLHBHHICTO-WCQGTBRESA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28ZS2SnXnc
Name 2-(Methoxycarbonyl)-1,3-dimethyl-9-oxabicyclo[3.3.1]non-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-11-5-4-6-12(2,16-11)9(8(13)7-11)10(14)15-3/h9H,4-7H2,1-3H3/t9-,11+,12-/m0/s1
InChIKey WYBANLHBHHICTO-WCQGTBRESA-N
Molecular Weight 226.272 g/mol
SMILES [C@]12([C@@](C(=O)C[C@@](O2)(C)CCC1)(C(=O)OC)[H])C
SPLASH splash10-0gx3-7900000000-0820ccffb293219f39ca
Source of Spectrum C-115-842-7
Synonyms 2-(Methoxycarbonyl)-1,5-dimethyl-9-oxabicyclo[3.3.1]non-3-one
Wiley ID 1227350