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(S)-(-)-4,8-Dimethyl-4-hydroxy-7-nonenenitrile
SpectraBase Compound ID IailKYXCKTQ
InChI InChI=1S/C11H19NO/c1-10(2)6-4-7-11(3,13)8-5-9-12/h6,13H,4-5,7-8H2,1-3H3/t11-/m0/s1
InChIKey MIEUKWYVXCQBAW-NSHDSACASA-N
Mol Weight 181.28 g/mol
Molecular Formula C11H19NO
Exact Mass 181.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBztxxIGhnp
Name (S)-(-)-4,8-Dimethyl-4-hydroxy-7-nonenenitrile
Classification Acyclic monoterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 181.146664235 u
Formula C11H19NO
InChI InChI=1S/C11H19NO/c1-10(2)6-4-7-11(3,13)8-5-9-12/h6,13H,4-5,7-8H2,1-3H3/t11-/m0/s1
InChIKey MIEUKWYVXCQBAW-NSHDSACASA-N
Molecular Weight 181.279 g/mol
Number of Peaks 21
SMILES O[C@@](CCC#N)(C)CCC=C(C)C
SPLASH splash10-0aou-9700000000-f8cdecfb536685d5cd50
Source of Spectrum FF-19-222-(S)_(_)_5 (DOI: 10.1002/ffj.1290)
Synonyms (S)-4-hydroxy-4,8-dimethylnon-7-enenitrile (4S)-4-hydroxy-4,8-dimethyl-7-nonenenitrile (4S)-4-hydroxy-4,8-dimethylnon-7-enenitrile (4S)-4,8-dimethyl-4-oxidanyl-non-7-enenitrile
Wiley ID 1775354