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Bicyclo[2.2.1]heptane-2-carboxylic acid, 5-(2-methoxy-2-oxoethylidene)-, methyl ester, (1.alpha.,2.beta.,4.alpha.,5E)-
SpectraBase Compound ID FJ1EEFtrbTB
InChI InChI=1S/C12H16O4/c1-15-11(13)6-8-4-9-3-7(8)5-10(9)12(14)16-2/h6-7,9-10H,3-5H2,1-2H3/b8-6+/t7-,9-,10+/m0/s1
InChIKey MKNAXCDAKQZIKO-IRZXYYMNSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHfbHU7msQY
Name Bicyclo[2.2.1]heptane-2-carboxylic acid, 5-(2-methoxy-2-oxoethylidene)-, methyl ester, (1.alpha.,2.beta.,4.alpha.,5E)-
Alternate Name(s) Methyl (1S,2R,4S,5E)-5-(2-methoxy-2-oxoethylidene)bicyclo[2.2.1]heptane-2-carboxylate Methyl 5-[(Z)-methoxycarbonylmethylidene]-8,9,10-trinorbornane-2endo-carboxylate
CAS Registry Number 85905-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-15-11(13)6-8-4-9-3-7(8)5-10(9)12(14)16-2/h6-7,9-10H,3-5H2,1-2H3/b8-6+/t7-,9-,10+/m0/s1
InChIKey MKNAXCDAKQZIKO-IRZXYYMNSA-N
Molecular Weight 224.256 g/mol
SMILES [C@@]12(\C(C[C@]([C@@](C2)(C(=O)OC)[H])([H])C1)=C\C(=O)OC)[H]
SPLASH splash10-0a70-8900000000-636103e72149d6fffb5f
Source of Spectrum H-65-2455-0
Wiley ID 1224950