For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(1R,3S,5R)-3-Hydroxymethyl-5-(4-methoxybenzyl)-1-(methoxycarbonyl)cyclohexane

View entire compound with spectra: 1 MS (GC)

(1R,3S,5R)-3-Hydroxymethyl-5-(4-methoxybenzyl)-1-(methoxycarbonyl)cyclohexane
SpectraBase Compound ID 8YlkeJihoQK
InChI InChI=1S/C17H24O4/c1-20-16-5-3-12(4-6-16)7-13-8-14(11-18)10-15(9-13)17(19)21-2/h3-6,13-15,18H,7-11H2,1-2H3/t13-,14+,15-/m1/s1
InChIKey KJLODGRWMHZJIN-QLFBSQMISA-N
Mol Weight 292.37 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DdaurmwnRKN
Name (1R,3S,5R)-3-Hydroxymethyl-5-(4-methoxybenzyl)-1-(methoxycarbonyl)cyclohexane
Alternate Name(s) cis,cis-3-Hydroxymethyl-5-(4-methoxybenzyl)-1-(methoxycarbonyl)cyclohexane Methyl (1R,3S,5R)-3-(hydroxymethyl)-5-(4-methoxybenzyl)cyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-20-16-5-3-12(4-6-16)7-13-8-14(11-18)10-15(9-13)17(19)21-2/h3-6,13-15,18H,7-11H2,1-2H3/t13-,14+,15-/m1/s1
InChIKey KJLODGRWMHZJIN-QLFBSQMISA-N
Molecular Weight 292.375 g/mol
SMILES OC[C@@]1(C[C@](C(=O)OC)(C[C@](Cc2ccc(cc2)OC)(C1)[H])[H])[H]
SPLASH splash10-001i-9000000000-30a66e70f5038456a431
Source of Spectrum F-53-12502-12
Wiley ID 803583