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4-Methyl-6-(2',6',6'-trimethylcyclohex-2'-en-1'-yl)hex-2-yne-1,4-diol

View entire compound with spectra: 1 MS (GC)

4-Methyl-6-(2',6',6'-trimethylcyclohex-2'-en-1'-yl)hex-2-yne-1,4-diol
SpectraBase Compound ID 7AeTkQTAblb
InChI InChI=1S/C16H26O2/c1-13-7-5-9-15(2,3)14(13)8-11-16(4,18)10-6-12-17/h7,14,17-18H,5,8-9,11-12H2,1-4H3
InChIKey ZBIZVNZLGOSBFD-UHFFFAOYSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B70GbnsPXSf
Name 4-Methyl-6-(2',6',6'-trimethylcyclohex-2'-en-1'-yl)hex-2-yne-1,4-diol
Alternate Name(s) 4-Methyl-6-(2,6,6-trimethyl-2-cyclohexen-1-yl)-2-hexyne-1,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-13-7-5-9-15(2,3)14(13)8-11-16(4,18)10-6-12-17/h7,14,17-18H,5,8-9,11-12H2,1-4H3
InChIKey ZBIZVNZLGOSBFD-UHFFFAOYSA-N
Molecular Weight 250.382 g/mol
SMILES OCC#CC(CCC1C(=CCCC1(C)C)C)(O)C
SPLASH splash10-05ad-9800000000-cde2dda1bc390263068e
Source of Spectrum H-87-1720-12
Wiley ID 1563937