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Methyl (4R,5S)-4,5-isopropylidenedioxyhex-2E-enoate
SpectraBase Compound ID 2TH7IsTC942
InChI InChI=1S/C10H16O4/c1-7-8(5-6-9(11)12-4)14-10(2,3)13-7/h5-8H,1-4H3/b6-5+/t7-,8+/m0/s1
InChIKey LWELGTICSFZEDV-LXBADBFVSA-N
Mol Weight 200.23 g/mol
Molecular Formula C10H16O4
Exact Mass 200.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVfOOjT8jPa
Name Methyl (4R,5S)-4,5-isopropylidenedioxyhex-2E-enoate
Alternate Name(s) (E)-3-[(4R,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoic acid methyl ester methyl (E)-3-[(4R,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]prop-2-enoate
Comments Less than 3 mono-isotopic peaks
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Formula C10H16O4
InChI InChI=1S/C10H16O4/c1-7-8(5-6-9(11)12-4)14-10(2,3)13-7/h5-8H,1-4H3/b6-5+/t7-,8+/m0/s1
InChIKey LWELGTICSFZEDV-LXBADBFVSA-N
Molecular Weight 200.234 g/mol
SMILES C1(O[C@](\C=C\C(=O)OC)([C@@](O1)(C)[H])[H])(C)C
SPLASH splash10-0a4i-0900000000-c513b1d1da1d10bf2f75
Source of Spectrum K-2001-3051-12
Wiley ID 1580035