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3-O-Acetyl-4-cyano-4-deoxy-1,2-O-isopropylidene-D-erythritol
SpectraBase Compound ID efXI5PSnwZ
InChI InChI=1S/C10H15NO4/c1-7(12)14-8(4-5-11)9-6-13-10(2,3)15-9/h8-9H,4,6H2,1-3H3/t8-,9+/m1/s1
InChIKey HZORQIPJUIRITQ-BDAKNGLRSA-N
Mol Weight 213.23 g/mol
Molecular Formula C10H15NO4
Exact Mass 213.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiHugLgs5qi
Name 3-O-Acetyl-4-cyano-4-deoxy-1,2-O-isopropylidene-D-erythritol
Alternate Name(s) (1R)-2-cyano-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO4
InChI InChI=1S/C10H15NO4/c1-7(12)14-8(4-5-11)9-6-13-10(2,3)15-9/h8-9H,4,6H2,1-3H3/t8-,9+/m1/s1
InChIKey HZORQIPJUIRITQ-BDAKNGLRSA-N
Molecular Weight 213.233 g/mol
SMILES C1OC(O[C@@]1([C@](OC(=O)C)(CC#N)[H])[H])(C)C
SPLASH splash10-0002-0900000000-a7f53878b921b0ce778b
Source of Spectrum J-66-6975-0
Wiley ID 1536021