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(Z)-Jasmolactone, extra C
SpectraBase Compound ID CJ6SWJlOnrW
InChI InChI=1S/C11H18O2/c1-2-3-4-5-7-10-8-6-9-11(12)13-10/h3-4,10H,2,5-9H2,1H3/b4-3-
InChIKey UJHDFCVFLRPEJQ-ARJAWSKDSA-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 FF9ThdKXbjD
Name Jasmolactone, extra C
CAS Registry Number 68959-28-4
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/c1-2-3-4-5-7-10-8-6-9-11(12)13-10/h3-4,10H,2,5-9H2,1H3/b4-3-
InChIKey UJHDFCVFLRPEJQ-ARJAWSKDSA-N
Molecular Weight 182.263 g/mol
Nominal Mass 182 u
Number of Peaks 76
SMILES C1(CCCC(O1)CC\C=C/CC)=O
SPLASH splash10-014i-9000000000-6c13ea04f4387a4973ac
Source ex BEDOUKIAN ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000800