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(2R,3S)-2-allyl-3-chloro-2-methyl-succinic acid diethyl ester
SpectraBase Compound ID 19KSAcRqYTr
InChI InChI=1S/C12H19ClO4/c1-5-8-12(4,11(15)17-7-3)9(13)10(14)16-6-2/h5,9H,1,6-8H2,2-4H3/t9-,12+/m1/s1
InChIKey ZSDOHWSLVNYQPJ-SKDRFNHKSA-N
Mol Weight 262.73 g/mol
Molecular Formula C12H19ClO4
Exact Mass 262.097187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHynR8pJjl2
Name (2R,3S)-2-allyl-3-chloro-2-methyl-succinic acid diethyl ester
Alternate Name(s) (2R,3S)-3-chloro-2-methyl-2-prop-2-enylbutanedioic acid diethyl ester Diethyl (2R,3S)-2-allyl-3-chloro-2-methyl-butanedioate Diethyl (2R,3S)-3-chloranyl-2-methyl-2-prop-2-enyl-butanedioate Diethyl (2R,3S)-3-chloro-2-methyl-2-prop-2-enylbutanedioate
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Formula C12H19ClO4
InChI InChI=1S/C12H19ClO4/c1-5-8-12(4,11(15)17-7-3)9(13)10(14)16-6-2/h5,9H,1,6-8H2,2-4H3/t9-,12+/m1/s1
InChIKey ZSDOHWSLVNYQPJ-SKDRFNHKSA-N
Molecular Weight 262.733 g/mol
SMILES [C@@]([C@@](C(=O)OCC)(Cl)[H])(C(=O)OCC)(CC=C)C
SPLASH splash10-0f6x-0910000000-366d8e3ea24d157810b8
Source of Spectrum KC-0-2102-9
Wiley ID 822979