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trans-1-(3-Methoxypropyl)-4-(trans-4-pentylcyclohexyl)cyclohexane
SpectraBase Compound ID EgBchBXpLx4
InChI InChI=1S/C21H40O/c1-3-4-5-7-18-9-13-20(14-10-18)21-15-11-19(12-16-21)8-6-17-22-2/h18-21H,3-17H2,1-2H3/t18-,19-,20-,21-
InChIKey YPPQHOSLRITBID-IFSQOONMSA-N
Mol Weight 308.6 g/mol
Molecular Formula C21H40O
Exact Mass 308.307916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kvvcJGqlU
Name trans-1-(3-Methoxypropyl)-4-(trans-4-pentylcyclohexyl)cyclohexane
Alternate Name(s) 1-[4-(3-methoxypropyl)cyclohexyl]-4-pentylcyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O
InChI InChI=1S/C21H40O/c1-3-4-5-7-18-9-13-20(14-10-18)21-15-11-19(12-16-21)8-6-17-22-2/h18-21H,3-17H2,1-2H3/t18-,19-,20-,21-
InChIKey YPPQHOSLRITBID-IFSQOONMSA-N
Molecular Weight 308.550 g/mol
SMILES [C@]1([C@]2(CC[C@@](CC2)(CCCOC)[H])[H])(CC[C@](CC1)(CCCCC)[H])[H]
SPLASH splash10-00ls-9310000000-b7a8eb65e44cef24f723
Source of Spectrum AJ-73-1890-14
Wiley ID 775534