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(Z)-5,6-Benzo-3,8,13-trioxa-15-methylbicyclo[13.1.0]-cis-hexadec-10-en-2-one
SpectraBase Compound ID B5myNXhMJXa
InChI InChI=1S/C18H22O4/c1-18-10-16(18)17(19)22-12-15-7-3-2-6-14(15)11-20-8-4-5-9-21-13-18/h2-7,16H,8-13H2,1H3/b5-4-/t16-,18+/m1/s1
InChIKey BFJNZDUFSJXMRO-TWZRTHNCSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VFzdsLladB
Name (Z)-5,6-Benzo-3,8,13-trioxa-15-methylbicyclo[13.1.0]-cis-hexadec-10-en-2-one
Alternate Name(s) (1aR,16aS)-1a-methyl-1,1a,2,4,7,9,14,16a-octahydro-16H-cyclopropa[d][2,7,12]benzotrioxacyclopentadecin-16-one
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Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-18-10-16(18)17(19)22-12-15-7-3-2-6-14(15)11-20-8-4-5-9-21-13-18/h2-7,16H,8-13H2,1H3/b5-4-/t16-,18+/m1/s1
InChIKey BFJNZDUFSJXMRO-TWZRTHNCSA-N
Molecular Weight 302.370 g/mol
SMILES [C@@]12([C@](C(OCc3c(COC\C=C/COC2)cccc3)=O)([H])C1)C
SPLASH splash10-0nmi-4910000000-fc51b99cd7d02a2191ef
Source of Spectrum C-119-8835-26
Wiley ID 760551