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1-O-acetyl-2,3-O-ethylene-4,6-O-isopropylidene-D-glucopyranose
SpectraBase Compound ID ZSm181Cm8t
InChI InChI=1S/C13H20O7/c1-7(14)18-12-11-10(15-4-5-16-11)9-8(19-12)6-17-13(2,3)20-9/h8-12H,4-6H2,1-3H3/t8-,9-,10+,11-,12?/m1/s1
InChIKey KETTZKACPYPHKF-OZRWLHRGSA-N
Mol Weight 288.3 g/mol
Molecular Formula C13H20O7
Exact Mass 288.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7QIcVRtLS2
Name 1-O-acetyl-2,3-O-ethylene-4,6-O-isopropylidene-D-glucopyranose
Alternate Name(s) (1S,2R,7R,10R)-4,4-dimethyl-3,5,8,11,14-pentaoxatricyclo[8.4.0.0(2,7)]tetradecan-9-yl acetate
CAS Registry Number 125631-32-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O7
InChI InChI=1S/C13H20O7/c1-7(14)18-12-11-10(15-4-5-16-11)9-8(19-12)6-17-13(2,3)20-9/h8-12H,4-6H2,1-3H3/t8-,9-,10+,11-,12?/m1/s1
InChIKey KETTZKACPYPHKF-OZRWLHRGSA-N
Molecular Weight 288.296 g/mol
SMILES C1([C@]2([C@@](OCCO2)([C@]2([C@](O1)(COC(C)(C)O2)[H])[H])[H])[H])OC(=O)C
SPLASH splash10-014i-0091000000-23f1398ce7417c32dd03
Source of Spectrum KC-1989-1808-9
Wiley ID 1291424