John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=K2oswcUuz6B SpectraBase Spectrum ID=11HkuRGwULg

(accessed ).
DL-(1-ALPHA,6-BETA,7-ALPHA)-6-ACETOXY-(E)-8-OXA-TETRACYCLO-[5.1.0.0(2,4).0(3,5)]-OCTAN-3-CARBONITRILE
SpectraBase Compound ID K2oswcUuz6B
InChI InChI=1S/C10H9NO3/c1-3(12)13-7-5-4-6(8-9(7)14-8)10(4,5)2-11/h4-9H,1H3/t4-,5+,6+,7-,8+,9-,10+/m1/s1
InChIKey IBWDNLPLYCYZJT-UZPMSTKZSA-N
Mol Weight 191.19 g/mol
Molecular Formula C10H9NO3
Exact Mass 191.058243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11HkuRGwULg
Name DL-(1-ALPHA,6-BETA,7-ALPHA)-6-ACETOXY-(E)-8-OXA-TETRACYCLO-[5.1.0.0(2,4).0(3,5)]-OCTAN-3-CARBONITRILE
CAS Registry Number 133796-61-9
Compound Number 11B
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9NO3
InChI InChI=1S/C10H9NO3/c1-3(12)13-7-5-4-6(8-9(7)14-8)10(4,5)2-11/h4-9H,1H3/t4-,5+,6+,7-,8+,9-,10+/m1/s1
InChIKey IBWDNLPLYCYZJT-UZPMSTKZSA-N
Literature Reference Author B.TRUPP,H.FRITZ,H.PRINZBACH,H.IRNGARTINGER,U.REIFENSTAHL
Literature Reference Citation CHEM.BER.,124,1777(1991)
Literature Reference DOI 10.1002/cber.19911240815
Molecular Weight 191.186 g/mol
Solvent ACETONE-D6
Source File Reference UWCS11727
SpectraBase Batch ID AMsYqRG0BVy