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MENTHOL, 1'-(BUTIN-3-ON-1-YL)-, (1R,2S,5R)-
SpectraBase Compound ID ADLt79qI1uc
InChI InChI=1S/C11H16O.C3H8/c1-9-4-3-5-11(8-9)7-6-10(2)12;1-3-2/h9,11H,3-5,8H2,1-2H3;3H2,1-2H3
InChIKey CKCKSQWHINCRKY-UHFFFAOYSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaFHUmi0mAg
Name MENTHOL, 1'-(BUTIN-3-ON-1-YL)-, (1R,2S,5R)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C11H16O.C3H8/c1-9-4-3-5-11(8-9)7-6-10(2)12;1-3-2/h9,11H,3-5,8H2,1-2H3;3H2,1-2H3
InChIKey CKCKSQWHINCRKY-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 208.1821
SMILES C(C)C.C1CCC(C#CC(C)=O)CC1C
SPLASH splash10-0006-9400000000-d9f1fd591729f26100c3
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany