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2-HYDROXYMETHYL-DELTA4-OCTALIN-1-CARBOXYLIC ACID, LACTONE
SpectraBase Compound ID GZkIVZwfT0C
InChI InChI=1S/C12H16O2/c13-12-11-9(7-14-12)6-5-8-3-1-2-4-10(8)11/h5,9-11H,1-4,6-7H2/t9-,10-,11+/m1/s1
InChIKey PNGYXNPBGYWZHZ-MXWKQRLJSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5QAtf8NEAVK
Name 2-HYDROXYMETHYL-DELTA4-OCTALIN-1-CARBOXYLIC ACID, LACTONE
Comments 16
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c13-12-11-9(7-14-12)6-5-8-3-1-2-4-10(8)11/h5,9-11H,1-4,6-7H2/t9-,10-,11+/m1/s1
InChIKey PNGYXNPBGYWZHZ-MXWKQRLJSA-N
Instrument Name Bruker HX-90
Literature Reference V.A.DENISENKO, V.L.NOVIKOV, G.B.ELYAKOV (1979) Izv.Akad.Nauk SSSR(Russ. Lang.):N4, 777-783.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD4O methanol-d4