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1-Hydroxymethyl-3,5-dimethyl-adamantane

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1-Hydroxymethyl-3,5-dimethyl-adamantane
SpectraBase Compound ID Z5bx2Yszug
InChI InChI=1S/C13H22O/c1-11-3-10-4-12(2,6-11)8-13(5-10,7-11)9-14/h10,14H,3-9H2,1-2H3/t10-,11+,12-,13-
InChIKey RVWLWJAOIBEWAV-WNGYAQOMSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sKcsYWeG8T
Name 1-Hydroxymethyl-3,5-dimethyl-adamantane
CAS Registry Number 26919-42-6
Comments C11 LABELED WITH 13-C
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-11-3-10-4-12(2,6-11)8-13(5-10,7-11)9-14/h10,14H,3-9H2,1-2H3/t10-,11+,12-,13-
InChIKey RVWLWJAOIBEWAV-WNGYAQOMSA-N
Instrument Name Bruker WH-90
Literature Reference S.R. Walter, J.L. Marshall, C.R. McDaniel, J. Am. Chem. Soc. 105, 4185 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3