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(3R,4S)-3,4-bis(oxidanyl)hex-5-enenitrile

View entire compound with spectra: 1 MS (GC)

(3R,4S)-3,4-bis(oxidanyl)hex-5-enenitrile
SpectraBase Compound ID 4xDl1khDCcQ
InChI InChI=1S/C6H9NO2/c1-2-5(8)6(9)3-4-7/h2,5-6,8-9H,1,3H2/t5-,6+/m0/s1
InChIKey LOSAEVSPFXEOAG-NTSWFWBYSA-N
Mol Weight 127.14 g/mol
Molecular Formula C6H9NO2
Exact Mass 127.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3hQJMMS5A0
Name (3R,4S)-3,4-bis(oxidanyl)hex-5-enenitrile
Alternate Name(s) (3R,4S)-3,4-dihydroxy-5-hexenenitrile (3R,4S)-3,4-dihydroxyhex-5-enenitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NO2
InChI InChI=1S/C6H9NO2/c1-2-5(8)6(9)3-4-7/h2,5-6,8-9H,1,3H2/t5-,6+/m0/s1
InChIKey LOSAEVSPFXEOAG-NTSWFWBYSA-N
Molecular Weight 127.143 g/mol
SMILES O[C@]([C@@](CC#N)(O)[H])(C=C)[H]
SPLASH splash10-000i-9300000000-349b8c51def3335b0545
Source of Spectrum F-53-1375-8
Wiley ID 800348