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4-(1-Cycloheptenyl)-2,3-dimethoxy-4-hydroxy-2-cyclobuten-1-one
SpectraBase Compound ID IsYy3bCxKzX
InChI InChI=1S/C13H18O4/c1-16-10-11(14)13(15,12(10)17-2)9-7-5-3-4-6-8-9/h7,15H,3-6,8H2,1-2H3
InChIKey FYUKIXNJQLUTGO-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkUHd6qTQ4a
Name 4-(1-Cycloheptenyl)-2,3-dimethoxy-4-hydroxy-2-cyclobuten-1-one
Alternate Name(s) 4-(1-cyclohepten-1-yl)-4-hydroxy-2,3-dimethoxy-2-cyclobuten-1-one
CAS Registry Number 124618-66-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c1-16-10-11(14)13(15,12(10)17-2)9-7-5-3-4-6-8-9/h7,15H,3-6,8H2,1-2H3
InChIKey FYUKIXNJQLUTGO-UHFFFAOYSA-N
Molecular Weight 238.283 g/mol
SMILES OC1(C(OC)=C(C1=O)OC)C1=CCCCCC1
SPLASH splash10-014i-9210000000-6acb7a453bc3c8fc84ab
Source of Spectrum C-112-1901-7
Wiley ID 1240526