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1-(2,3-O-Isopropylidene-5-O-acetyl-.beta.-D-ribofuranosyl)indole
SpectraBase Compound ID D11eQBXeGYj
InChI InChI=1S/C18H21NO5/c1-11(20)21-10-14-15-16(24-18(2,3)23-15)17(22-14)19-9-8-12-6-4-5-7-13(12)19/h4-9,14-17H,10H2,1-3H3/t14-,15-,16-,17-/m1/s1
InChIKey MDAQVJHQSWOYLO-QBPKDAKJSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyGYD3qNEmT
Name 1-(2,3-O-Isopropylidene-5-O-acetyl-.beta.-D-ribofuranosyl)indole
Appearance Colorless oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-11(20)21-10-14-15-16(24-18(2,3)23-15)17(22-14)19-9-8-12-6-4-5-7-13(12)19/h4-9,14-17H,10H2,1-3H3/t14-,15-,16-,17-/m1/s1
InChIKey MDAQVJHQSWOYLO-QBPKDAKJSA-N
Instrument Name Finigan SSQ 700
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.809
Molecular Weight 331.368 g/mol
Optical Rotation [a]D20 = -49.4 (c = 0.71, CHCl3)
SMILES c1cc2c(cc1)[n](cc2)[C@]1([C@]2([C@@]([C@](O1)(COC(C)=O)[H])(OC(O2)(C)C)[H])[H])[H]
SPLASH splash10-001l-5409000000-874a8d5e964d15e6b17f
Source of Spectrum ARK-2008-95-11b
Thin-Layer Chromatography Rf = 0.41 (cyclohexane/acetone, 4:1)
Wiley ID 1869551