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CALAMUSTROPONE
SpectraBase Compound ID 1IxffGRCORi
InChI InChI=1S/C12H14O/c1-8-3-5-12-9(2)7-10(13)4-6-11(8)12/h4,6-8H,3,5H2,1-2H3
InChIKey MDFATIDEXXOYPV-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7dRZGwDuCW6
Name 3,8-Dimethyl-1,2,3,6-tetrahydro-azulene-6-one
CAS Registry Number 77809-01-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14O
InChI InChI=1S/C12H14O/c1-8-3-5-12-9(2)7-10(13)4-6-11(8)12/h4,6-8H,3,5H2,1-2H3
InChIKey MDFATIDEXXOYPV-UHFFFAOYSA-N
Literature Reference M. Rohr, P. Naegeli, Phytochem. 18, 279 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3