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(Z)-BOMBARDOLIDE-A;MAJOR-ISOMER
SpectraBase Compound ID HthR3IYjVdL
InChI InChI=1S/C10H12O3/c1-2-4-9-7-8(5-3-6-11)10(12)13-9/h3-5,7,11H,2,6H2,1H3/b5-3+,9-4-
InChIKey YGPGUEZTBZXORL-PVOUKABXSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FF5TdhgFezS
Name (E/Z)-Bombardolide A
Alternate Name(s) (5Z)-3-[(E)-3-hydroxyprop-1-enyl]-5-propylidene-2-furanone (5Z)-3-[(E)-3-hydroxyprop-1-enyl]-5-propylidene-furan-2-one (5Z)-3-[(E)-3-oxidanylprop-1-enyl]-5-propylidene-furan-2-one
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Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-2-4-9-7-8(5-3-6-11)10(12)13-9/h3-5,7,11H,2,6H2,1H3/b5-3+,9-4-
InChIKey YGPGUEZTBZXORL-PVOUKABXSA-N
Molecular Weight 180.203 g/mol
SMILES OC\C=C\C=1C(O\C(=C/CC)C1)=O
SPLASH splash10-01q9-3900000000-eaed18691bfb51e39c27
Source of Spectrum G4-64-811-1
Wiley ID 1609059