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Naphtho[2,1-b]furan-2(3aH)-one, 4,5,5a,6,7,8,9,9a-octahydro-3a-hydroperoxy-6,9a-dimethyl-, [3aS-(3a.alpha.,5a.beta.,6.alpha.,9a.alpha.)]-
SpectraBase Compound ID eBo4YUzFX3
InChI InChI=1S/C14H20O4/c1-9-4-3-6-13(2)10(9)5-7-14(18-16)11(13)8-12(15)17-14/h8-10,16H,3-7H2,1-2H3/t9-,10-,13-,14-/m0/s1
InChIKey OTUKHWVSKHTCEB-NUZBWSBOSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5b1xwyPvt1
Name Naphtho[2,1-b]furan-2(3aH)-one, 4,5,5a,6,7,8,9,9a-octahydro-3a-hydroperoxy-6,9a-dimethyl-, [3aS-(3a.alpha.,5a.beta.,6.alpha.,9a.alpha.)]-
CAS Registry Number 82079-86-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-9-4-3-6-13(2)10(9)5-7-14(18-16)11(13)8-12(15)17-14/h8-10,16H,3-7H2,1-2H3/t9-,10-,13-,14-/m0/s1
InChIKey OTUKHWVSKHTCEB-NUZBWSBOSA-N
Molecular Weight 252.310 g/mol
SMILES OO[C@@]12C([C@@]3([C@@](CC2)([C@@](C)(CCC3)[H])[H])C)=CC(=O)O1
SPLASH splash10-066u-9270000000-198503a42807cb6366d1
Source of Spectrum B-35-609-0
Synonyms (3aS,5aS,6S,9aS)-3a-hydroperoxy-6,9a-dimethyl-4,5,5a,6,7,8,9,9a-octahydronaphtho[2,1-b]furan-2(3aH)-one 8.beta.-hydroperoxy-13,14,15,16,17,18-hexanorlabd-9(11)-eno-12,8.alpha.-lactone
Wiley ID 1255565