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(3Z)-Jasmone lactone
SpectraBase Compound ID HFS9zblQnXT
InChI InChI=1S/C11H18O2/c1-3-4-5-6-8-11(2)9-7-10(12)13-11/h4-5H,3,6-9H2,1-2H3/b5-4-
InChIKey NIKDJTTZUYNCMM-PLNGDYQASA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkkuwvnxJqY
Name Jasmone lactone<3Z->
CAS Registry Number 70851-61-5
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 182.130679818 u
Formula C11H18O2
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/C11H18O2/c1-3-4-5-6-8-11(2)9-7-10(12)13-11/h4-5H,3,6-9H2,1-2H3/b5-4-
InChIKey NIKDJTTZUYNCMM-PLNGDYQASA-N
Molecular Weight 182.263 g/mol
Nominal Mass 182 u
Number of Peaks 93
SMILES C1CC(OC1=O)(CC\C=C/CC)C
SPLASH splash10-014l-9100000000-f390237b879e6717a6bf
Source ex BEDOUKIAN CHEM.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000804