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anti,syn-4,6-Dimethyl-7-(triphenylmethyloxy)heptan-2-ol
SpectraBase Compound ID CV7omPbp8cp
InChI InChI=1S/C28H34O2/c1-22(20-24(3)29)19-23(2)21-30-28(25-13-7-4-8-14-25,26-15-9-5-10-16-26)27-17-11-6-12-18-27/h4-18,22-24,29H,19-21H2,1-3H3/t22-,23+,24+/m1/s1
InChIKey NGLDBNZFCGWGMS-SGNDLWITSA-N
Mol Weight 402.6 g/mol
Molecular Formula C28H34O2
Exact Mass 402.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRfcNIcmliC
Name anti,syn-4,6-Dimethyl-7-(triphenylmethyloxy)heptan-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H34O2
InChI InChI=1S/C28H34O2/c1-22(20-24(3)29)19-23(2)21-30-28(25-13-7-4-8-14-25,26-15-9-5-10-16-26)27-17-11-6-12-18-27/h4-18,22-24,29H,19-21H2,1-3H3/t22-,23+,24+/m1/s1
InChIKey NGLDBNZFCGWGMS-SGNDLWITSA-N
Instrument Name Fisons NV GC 8060
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.72
Molecular Weight 402.578 g/mol
SMILES O[C@](C[C@@](C[C@@](COC(c1ccccc1)(c1ccccc1)c1ccccc1)(C)[H])(C)[H])(C)[H]
SPLASH splash10-0006-3690000000-3fcf925359086df429d0
Source of Spectrum BJO-10-SM17-18
Wiley ID 1854163