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(1S,6R,7S)-7-Hydroxymethyl-8-oxabicyclo[4.3.0]-3-nonen-9-one
SpectraBase Compound ID Hi2BpPqB8eW
InChI InChI=1S/C9H12O3/c10-5-8-6-3-1-2-4-7(6)9(11)12-8/h1-2,6-8,10H,3-5H2/t6-,7+,8-/m1/s1
InChIKey YIDWWXHEGSTYKG-GJMOJQLCSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIReXOgK6IB
Name (1S,6R,7S)-7-Hydroxymethyl-8-oxabicyclo[4.3.0]-3-nonen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c10-5-8-6-3-1-2-4-7(6)9(11)12-8/h1-2,6-8,10H,3-5H2/t6-,7+,8-/m1/s1
InChIKey YIDWWXHEGSTYKG-GJMOJQLCSA-N
Molecular Weight 168.192 g/mol
SMILES OC[C@]1(OC([C@@]2([C@]1(CC=CC2)[H])[H])=O)[H]
SPLASH splash10-004i-9000000000-0c6613c2c04367abe825
Source of Spectrum F-48-2677-34
Synonyms (3S,3aR,7aS)-3-(hydroxymethyl)-3a,4,7,7a-tetrahydro-2-benzofuran-1(3H)-one
Wiley ID 1164414