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8-epi-Dictamnol
SpectraBase Compound ID LHsFzUbD5dc
InChI InChI=1S/C12H18O/c1-9-5-3-4-6-11-10(9)7-8-12(11,2)13/h4,6,10-11,13H,1,3,5,7-8H2,2H3/t10-,11-,12+/m0/s1
InChIKey FIZZAWTVIDYQPI-SDDRHHMPSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBOGDj5NeKJ
Name Dictamnol<8-epi->
CAS Registry Number 195259-46-2
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 178.135765199 u
Formula C12H18O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C12H18O/c1-9-5-3-4-6-11-10(9)7-8-12(11,2)13/h4,6,10-11,13H,1,3,5,7-8H2,2H3/t10-,11-,12+/m0/s1
InChIKey FIZZAWTVIDYQPI-SDDRHHMPSA-N
Molecular Weight 178.275 g/mol
Nominal Mass 178 u
Number of Peaks 100
SMILES O[C@@]1(C)[C@@]2([H])C=CCCC(=C)[C@]2([H])CC1
SPLASH splash10-0006-9400000000-f5de941dc7dc2bb8c3bc
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000473