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2(5H)-Oxoninone, 3-fluoro-6,7,8,9-tetrahydro-4-methyl-, (Z)-
SpectraBase Compound ID 45DDBujGwAz
InChI InChI=1S/C9H13FO2/c1-7-5-3-2-4-6-12-9(11)8(7)10/h2-6H2,1H3/b8-7+
InChIKey PEZFIISHKUPWEJ-BQYQJAHWSA-N
Mol Weight 172.2 g/mol
Molecular Formula C9H13FO2
Exact Mass 172.089958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KS2uJMOjXff
Name 2(5H)-Oxoninone, 3-fluoro-6,7,8,9-tetrahydro-4-methyl-, (Z)-
Alternate Name(s) 2(5H)-Oxoninone, 3-fluoro-6,7,8,9-tetrahydro-4-methyl-, (E)- 3-Fluoro-4-methyl-6,7,8,9-tetrahydro-2(5H)-oxoninone E-2-fluoro-3-methyl-2-octenolide Z-2-fluoro-3-methyl-2-octenolide
CAS Registry Number 127974-44-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13FO2
InChI InChI=1S/C9H13FO2/c1-7-5-3-2-4-6-12-9(11)8(7)10/h2-6H2,1H3/b8-7+
InChIKey PEZFIISHKUPWEJ-BQYQJAHWSA-N
Molecular Weight 172.199 g/mol
SMILES C1(\C(=C/(CCCCCO1)C)F)=O
SPLASH splash10-03k9-9500000000-4937b6765a472e1f7a78
Source of Spectrum J-55-4815-4
Wiley ID 1168645