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4,5,6,7,8,9-HEXAHYDRO-CYCLOOCTA-[C]-FURAN-1(3H)-ONE
SpectraBase Compound ID 6XNCRaFJ2xt
InChI InChI=1S/C10H14O2/c11-10-9-6-4-2-1-3-5-8(9)7-12-10/h1-7H2
InChIKey OIBXRZXMYKDUEM-UHFFFAOYSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fs8vycVMEyQ
Name 1-Cyclooctene-1-carboxylic acid, 2-(hydroxymethyl)-, .gamma.-lactone
Alternate Name(s) Cycloocta[c]furan-1(3H)-one, 4,5,6,7,8,9-hexahydro- 4,5,6,7,8,9-Hexahydrocycloocta[c]furan-1(3H)-one
CAS Registry Number 99172-53-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c11-10-9-6-4-2-1-3-5-8(9)7-12-10/h1-7H2
InChIKey OIBXRZXMYKDUEM-UHFFFAOYSA-N
Molecular Weight 166.220 g/mol
SMILES C1(C2=C(CCCCCC2)CO1)=O
SPLASH splash10-00kr-0900000000-9c8c743e7a909bbcb879
Source of Spectrum K-124-1876-2
Wiley ID 1162737