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(4S)-2,3-Dicyano-hexahydropyrrolo[1,2-b]isoxazol-4-ol

View entire compound with spectra: 1 MS (GC)

(4S)-2,3-Dicyano-hexahydropyrrolo[1,2-b]isoxazol-4-ol
SpectraBase Compound ID LErsjBFBwVo
InChI InChI=1S/C8H9N3O2/c9-3-5-7(4-10)13-11-2-1-6(12)8(5)11/h5-8,12H,1-2H2/t5?,6-,7?,8?/m0/s1
InChIKey XMPPVVTXGWTOLH-GGRBJAFOSA-N
Mol Weight 179.18 g/mol
Molecular Formula C8H9N3O2
Exact Mass 179.069477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AM1qHOoipL
Name (4S)-2,3-Dicyano-hexahydropyrrolo[1,2-b]isoxazol-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9N3O2
InChI InChI=1S/C8H9N3O2/c9-3-5-7(4-10)13-11-2-1-6(12)8(5)11/h5-8,12H,1-2H2/t5?,6-,7?,8?/m0/s1
InChIKey XMPPVVTXGWTOLH-GGRBJAFOSA-N
Molecular Weight 179.179 g/mol
SMILES O[C@@]1(C2C(C#N)C(ON2CC1)C#N)[H]
SPLASH splash10-004i-9000000000-e5ac3de2873a5c03f5a2
Source of Spectrum U1-2002-1948-16
Synonyms (4S)-4-hydroxyhexahydropyrrolo[1,2-b]isoxazole-2,3-dicarbonitrile 2,3-Dicyano-hexahydropyrrolo[1,2-b]isoxazol-4-ol
Wiley ID 1522604