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NUAPAPUIN-A
SpectraBase Compound ID EhqTNbuRrCW
InChI InChI=1S/C20H34O4/c1-14-8-7-11-19(3,4)16(14)9-12-20(5)13-10-17(23-24-20)15(2)18(21)22-6/h15,17H,7-13H2,1-6H3/t15-,17-,20-/m1/s1
InChIKey MRBQQESZUMBYBU-WRWLIDTKSA-N
Mol Weight 338.5 g/mol
Molecular Formula C20H34O4
Exact Mass 338.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQ15S8trzJ1
Name Nuapapuin A - methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O4
InChI InChI=1S/C20H34O4/c1-14-8-7-11-19(3,4)16(14)9-12-20(5)13-10-17(23-24-20)15(2)18(21)22-6/h15,17H,7-13H2,1-6H3/t15-,17-,20-/m1/s1
InChIKey MRBQQESZUMBYBU-WRWLIDTKSA-N
Molecular Weight 338.488 g/mol
SMILES C1(=C(CCCC1(C)C)C)CC[C@]1(OO[C@@]([C@](C(=O)OC)(C)[H])(CC1)[H])C
SPLASH splash10-001i-9000000000-458a9adc8cc03cc4b698
Source of Spectrum G4-62-217-2
Synonyms (2R)-2-[(3R,6R)-6-methyl-6-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethyl]-3-dioxanyl]propanoic acid methyl ester Methyl (2R)-2-[(3R,6R)-6-methyl-6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]dioxan-3-yl]propanoate Methyl (2R)-2-[(3R,6R)-6-methyl-6-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]-1,2-dioxan-3-yl]propanoate
Wiley ID 1607724