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7-O-(3'-hydroxymethyl-1'(E)-butenyl)umbelliferone
SpectraBase Compound ID LKovU2Uhj7y
InChI InChI=1S/C14H14O4/c1-10(9-15)6-7-17-12-4-2-11-3-5-14(16)18-13(11)8-12/h2-8,10,15H,9H2,1H3/b7-6+
InChIKey JAYZSRBMHBCFRV-VOTSOKGWSA-N
Mol Weight 246.26 g/mol
Molecular Formula C14H14O4
Exact Mass 246.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XZIPoBrG7t
Name 7-O-(3'-hydroxymethyl-1'(E)-butenyl)umbelliferone
Alternate Name(s) 7-{[(1E)-4-hydroxy-3-methyl-1-butenyl]oxy}-2H-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O4
InChI InChI=1S/C14H14O4/c1-10(9-15)6-7-17-12-4-2-11-3-5-14(16)18-13(11)8-12/h2-8,10,15H,9H2,1H3/b7-6+
InChIKey JAYZSRBMHBCFRV-VOTSOKGWSA-N
Molecular Weight 246.262 g/mol
SMILES OCC(\C=C\Oc1cc2OC(C=Cc2cc1)=O)C
SPLASH splash10-014i-1390000000-4110b042d32458f09e14
Source of Spectrum LQ-1992-3399-0
Wiley ID 1248954