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Cyclododecanol, 2-methyl-1-(1-propynyl)-, (1R*,2S*)-
SpectraBase Compound ID CfzdmQ5ITet
InChI InChI=1S/C16H28O/c1-3-13-16(17)14-11-9-7-5-4-6-8-10-12-15(16)2/h15,17H,4-12,14H2,1-2H3
InChIKey YNYULQMNJMGASK-UHFFFAOYSA-N
Mol Weight 236.4 g/mol
Molecular Formula C16H28O
Exact Mass 236.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3b0u43O97Yn
Name Cyclododecanol, 2-methyl-1-(1-propynyl)-, (1R*,2S*)-
Alternate Name(s) 2-Methyl-1-(1'-propynyl)-1-cyclododecanol 2-Methyl-1-(1-propynyl)cyclododecanol
CAS Registry Number 65691-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O
InChI InChI=1S/C16H28O/c1-3-13-16(17)14-11-9-7-5-4-6-8-10-12-15(16)2/h15,17H,4-12,14H2,1-2H3
InChIKey YNYULQMNJMGASK-UHFFFAOYSA-N
Molecular Weight 236.399 g/mol
SMILES OC1(C#CC)C(C)CCCCCCCCCC1
SPLASH splash10-07c5-9200000000-d733d0479f8e1b006c80
Source of Spectrum H-60-3058-0
Wiley ID 1239003