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Isobenzofuran, 1,3,3a,4,5,7a-hexahydro-, trans-
SpectraBase Compound ID Hh58xYlJigK
InChI InChI=1S/C8H12O/c1-2-4-8-6-9-5-7(8)3-1/h1,3,7-8H,2,4-6H2/t7-,8-/m1/s1
InChIKey HTGMLRPUGQRWDI-HTQZYQBOSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8LbSuumBK9J
Name Isobenzofuran, 1,3,3a,4,5,7a-hexahydro-, trans-
CAS Registry Number 74626-68-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-2-4-8-6-9-5-7(8)3-1/h1,3,7-8H,2,4-6H2/t7-,8-/m1/s1
InChIKey HTGMLRPUGQRWDI-HTQZYQBOSA-N
Molecular Weight 124.183 g/mol
SMILES C1OC[C@]2(CCC=C[C@]12[H])[H]
SPLASH splash10-004i-9000000000-63faf8a6407929519787
Source of Spectrum C-113-665-36
Synonyms (3aS,7aS)-1,3,3a,4,5,7a-hexahydro-2-benzofuran 1,3,3a,4,5,7a-hexhydro-trans-isobenzofuran
Wiley ID 1129067