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AQKZNTBBGPQPBG-RNFRBKRXSA-N
SpectraBase Compound ID HosvwAGtpAn
InChI InChI=1S/C8H12O2/c9-8-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2/t6-,7-/m1/s1
InChIKey AQKZNTBBGPQPBG-RNFRBKRXSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0zZvIf2uFa
Name (3aR,7aR)-3a,4,5,6,7,7a-hexahydro-3H-1-benzofuran-2-one
CAS Registry Number 24871-12-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/C8H12O2/c9-8-5-6-3-1-2-4-7(6)10-8/h6-7H,1-5H2/t6-,7-/m1/s1
InChIKey AQKZNTBBGPQPBG-RNFRBKRXSA-N
Molecular Weight 140.182 g/mol
SMILES C1(O[C@]2([C@@](C1)(CCCC2)[H])[H])=O
SPLASH splash10-017l-9000000000-53f34a9c4dad039fc89b
Source of Spectrum FV-7-0-0
Synonyms (3aR,7aR)-3a,4,5,6,7,7a-hexahydro-3H-benzofuran-2-one
Wiley ID 1139352