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2-METHOXYTROPONE
SpectraBase Compound ID DtqXIUIJsKa
InChI InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3
InChIKey IQYJSKNHDZZDGA-UHFFFAOYSA-N
Mol Weight 136.15 g/mol
Molecular Formula C8H8O2
Exact Mass 136.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOhDyFrv0qz
Name 2,4,6-Cycloheptatrien-1-one, 2-methoxy-
Alternate Name(s) .alpha.-Methoxytropone .alpha.-Tropolone methyl ether 2-c-Methoxytropone 2-methoxy-1-cyclohepta-2,4,6-trienone 2-Methoxy-2,4,6-cycloheptatrien-1-one 2-methoxycyclohepta-2,4,6-trien-1-one 2-Methoxycycloheptatrienone 2-Methoxytropolone 2-Methoxytropone Tropolone methyl ether BRN 2041321
CAS Registry Number 2161-40-2
Comments Less than 3 mono-isotopic peaks
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Formula C8H8O2
InChI InChI=1S/C8H8O2/c1-10-8-6-4-2-3-5-7(8)9/h2-6H,1H3
InChIKey IQYJSKNHDZZDGA-UHFFFAOYSA-N
Molecular Weight 136.150 g/mol
SMILES C=1(C(C=CC=CC1)=O)OC
SPLASH splash10-0a4r-0900000000-45f08e301d6691dbf3bc
Source of Spectrum QA-46-37-5
Wiley ID 863110