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(2E)-5-hydroxy-2-methyl-2-pentenenitrile
SpectraBase Compound ID ByZZ3FwQrAj
InChI InChI=1S/C6H9NO/c1-6(5-7)3-2-4-8/h3,8H,2,4H2,1H3/b6-3+
InChIKey TVSGYFGHTQACOW-ZZXKWVIFSA-N
Mol Weight 111.14 g/mol
Molecular Formula C6H9NO
Exact Mass 111.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7qpLyC3NGIh
Name (2E)-5-hydroxy-2-methyl-2-pentenenitrile
Alternate Name(s) (E)-2-methyl-5-oxidanyl-pent-2-enenitrile (E)-5-hydroxy-2-methyl-2-pentenenitrile (E)-5-hydroxy-2-methyl-pent-2-enenitrile
CAS Registry Number 120697-04-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NO
InChI InChI=1S/C6H9NO/c1-6(5-7)3-2-4-8/h3,8H,2,4H2,1H3/b6-3+
InChIKey TVSGYFGHTQACOW-ZZXKWVIFSA-N
Molecular Weight 111.144 g/mol
SMILES OCC\C=C\(C#N)C
SPLASH splash10-001i-9000000000-95f63dde3b9fbc7512f6
Source of Spectrum B-41-1105-3
Wiley ID 1122850