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Isopropyl 6-O-acetyl-4-[bis(ethoxycarbonyl)but-3-ynyl]-2,3,4-trideoxy-.alpha.,D-erythro-hex-2-enopyranoside
SpectraBase Compound ID 61q9XE7W39Z
InChI InChI=1S/C21H30O8/c1-7-12-21(19(23)25-8-2,20(24)26-9-3)16-10-11-18(28-14(4)5)29-17(16)13-27-15(6)22/h1,10-11,14,16-18H,8-9,12-13H2,2-6H3
InChIKey ONVJIKWRVBWGBR-UHFFFAOYSA-N
Mol Weight 410.46 g/mol
Molecular Formula C21H30O8
Exact Mass 410.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QYqFinntK2
Name Isopropyl 6-O-acetyl-4-[bis(ethoxycarbonyl)but-3-ynyl]-2,3,4-trideoxy-.alpha.,D-erythro-hex-2-enopyranoside
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O8
InChI InChI=1S/C21H30O8/c1-7-12-21(19(23)25-8-2,20(24)26-9-3)16-10-11-18(28-14(4)5)29-17(16)13-27-15(6)22/h1,10-11,14,16-18H,8-9,12-13H2,2-6H3
InChIKey ONVJIKWRVBWGBR-UHFFFAOYSA-N
Molecular Weight 410.463 g/mol
SMILES C(C1C=CC(OC1COC(=O)C)OC(C)C)(C(=O)OCC)(C(=O)OCC)CC#C
SPLASH splash10-0udi-0009000000-47b78796082973be982d
Source of Spectrum F-53-3967-21
Synonyms diethyl 2-{2-[(acetyloxy)methyl]-6-isopropoxy-3,6-dihydro-2H-pyran-3-yl}-2-(2-propynyl)malonate
Wiley ID 801306