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3-Bromo-2,3,4,6,7,8-hexahydro-7-methyl-1-benzofuran-5(5H)-one
SpectraBase Compound ID HroqKgZfRkr
InChI InChI=1S/C10H13BrO2/c1-6-2-9(12)8-4-7(11)5-13-10(8)3-6/h6-7H,2-5H2,1H3
InChIKey RTJWYYSKWVTVJS-UHFFFAOYSA-N
Mol Weight 245.12 g/mol
Molecular Formula C10H13BrO2
Exact Mass 244.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bbv27OpxNjv
Name 3-Bromo-2,3,4,6,7,8-hexahydro-7-methyl-1-benzofuran-5(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13BrO2
InChI InChI=1S/C10H13BrO2/c1-6-2-9(12)8-4-7(11)5-13-10(8)3-6/h6-7H,2-5H2,1H3
InChIKey RTJWYYSKWVTVJS-UHFFFAOYSA-N
Molecular Weight 245.116 g/mol
SMILES C12=C(OCC(C2)Br)CC(C)CC1=O
SPLASH splash10-0uxu-7950000000-078e6a13e6e01079ba04
Source of Spectrum F5-3-2473-5b
Synonyms 3-Bromo-7-methyl-3,4,7,8-tetrahydro-2H-chromen-5(6H)-one 3-Bromo-7-methyl-2,3,4,6,7,8-hexahydro-1-benzopyran-5-one 3-Bromanyl-7-methyl-2,3,4,6,7,8-hexahydrochromen-5-one
Wiley ID 1732384