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endo-3-acetoxymethyltricyclo[6.4.0.0(2,5)]dodeca-1(12),6,8,10-tetraen-2-ol
SpectraBase Compound ID 49Fo9wDOMEp
InChI InChI=1S/C15H16O3/c1-10(16)18-9-13-8-12-7-6-11-4-2-3-5-14(11)15(12,13)17/h2-7,12-13,17H,8-9H2,1H3
InChIKey QYTDIKFNKGLNKB-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C15H16O3
Exact Mass 244.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QRt3Q1G4iU
Name endo-3-acetoxymethyltricyclo[6.4.0.0(2,5)]dodeca-1(12),6,8,10-tetraen-2-ol
Alternate Name(s) exo-3-acetoxymethyltricyclo[6.4.0.0(2,5)]dodeca-1(12),6,8,10-tetraen-2-ol (8b-hydroxy-1,2,2a,8b-tetrahydrocyclobuta[a]naphthalen-1-yl)methyl acetate
CAS Registry Number 118416-21-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O3
InChI InChI=1S/C15H16O3/c1-10(16)18-9-13-8-12-7-6-11-4-2-3-5-14(11)15(12,13)17/h2-7,12-13,17H,8-9H2,1H3
InChIKey QYTDIKFNKGLNKB-UHFFFAOYSA-N
Molecular Weight 244.290 g/mol
SMILES OC12C(COC(=O)C)CC2C=Cc2c1cccc2
SPLASH splash10-0006-0900000000-750e6341918c041336d1
Source of Spectrum KC-1988-496-24
Wiley ID 1247323