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Diethyl 4,4-dimethyl-3-(2-methyloxiran-2-yl)cyclohexane-1,1-dicarboxylate
SpectraBase Compound ID 50sa6UlUlel
InChI InChI=1S/C17H28O5/c1-6-20-13(18)17(14(19)21-7-2)9-8-15(3,4)12(10-17)16(5)11-22-16/h12H,6-11H2,1-5H3
InChIKey VNALRCVGTJHOTI-UHFFFAOYSA-N
Mol Weight 312.41 g/mol
Molecular Formula C17H28O5
Exact Mass 312.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79kSgxYOALe
Name Diethyl 4,4-dimethyl-3-(2-methyloxiran-2-yl)cyclohexane-1,1-dicarboxylate
Classification Monocyclic monoterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 312.193673997 u
Formula C17H28O5
InChI InChI=1S/C17H28O5/c1-6-20-13(18)17(14(19)21-7-2)9-8-15(3,4)12(10-17)16(5)11-22-16/h12H,6-11H2,1-5H3
InChIKey VNALRCVGTJHOTI-UHFFFAOYSA-N
Molecular Weight 312.406 g/mol
Number of Peaks 14
SMILES C1(CC(C(CC1)(C)C)C1(OC1)C)(C(=O)OCC)C(=O)OCC
SPLASH splash10-0a4i-7930000000-32b29bc5cf64e440352f
Source of Spectrum FF-29-60-3 (DOI: 10.1002/ffj.3180)
Wiley ID 1775640