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(2S,3R)-cis-endo-3-(2-Isopropoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID 45jeJLIsvnv
InChI InChI=1S/C12H16O4/c1-6(2)16-12(15)10-8-4-3-7(5-8)9(10)11(13)14/h3-4,6-10H,5H2,1-2H3,(H,13,14)/t7-,8+,9-,10+/m0/s1
InChIKey YPLRAQYWVXRZHI-QCLAVDOMSA-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 IZvczQcG7M
Name (2S,3R)-cis-endo-3-(2-Isopropoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-6(2)16-12(15)10-8-4-3-7(5-8)9(10)11(13)14/h3-4,6-10H,5H2,1-2H3,(H,13,14)/t7-,8+,9-,10+/m0/s1
InChIKey YPLRAQYWVXRZHI-QCLAVDOMSA-N
Molecular Weight 224.256 g/mol
SMILES OC([C@]1([C@]2(C=C[C@@]([C@]1(C(OC(C)C)=O)[H])(C2)[H])[H])[H])=O
SPLASH splash10-014i-3900000000-f4217fe326858d81ad9b
Source of Spectrum J-63-1195-3
Synonyms (2S,3R)-3-(isopropoxycarbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Wiley ID 1225057