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4-Hexenal, 5-(4-methyl-3-cyclohexen-1-yl)-, (E)-
SpectraBase Compound ID 6dtClau7NFy
InChI InChI=1S/C13H20O/c1-11-6-8-13(9-7-11)12(2)5-3-4-10-14/h5-6,10,13H,3-4,7-9H2,1-2H3/b12-5+
InChIKey AACAONQEJXPHAY-LFYBBSHMSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpBq9UsI1Pw
Name 4-Hexenal, 5-(4-methyl-3-cyclohexen-1-yl)-, (E)-
CAS Registry Number 73416-18-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-11-6-8-13(9-7-11)12(2)5-3-4-10-14/h5-6,10,13H,3-4,7-9H2,1-2H3/b12-5+
InChIKey AACAONQEJXPHAY-LFYBBSHMSA-N
Molecular Weight 192.302 g/mol
SMILES C1(\C(=C\CCC=O)C)CC=C(CC1)C
SPLASH splash10-00lv-9000000000-7cfb7e04a47f93607baf
Source of Spectrum H-62-2730-0
Synonyms (4E)-5-(4-methyl-3-cyclohexen-1-yl)-4-hexenal (E) and (Z)-5-(4-methyl-3-cyclohexen-1-yl)-4-hexanol
Wiley ID 1189157