Debug Info

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_id
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Kfmwrdb2yrr
spectrumID
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Kfmwrdb2yrr
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specType
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131072
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WMS3X:260070:1
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Mass Spectrum (GC)
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Naphth[2,3-b]oxirene-2-ethanol, decahydro-1a,2a,6,6-tetramethyl-, (1a.alpha.,2.beta.,2a.beta.,6a.beta.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID JVcgqj7fHwR
InChI InChI=1S/C16H28O2/c1-14(2)7-5-8-15(3)11(6-9-17)16(4)13(18-16)10-12(14)15/h11-13,17H,5-10H2,1-4H3/t11-,12-,13+,15-,16-/m1/s1
InChIKey QBQGGNGJCAJVIH-CNRIWFPOSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kfmwrdb2yrr
Name Naphth[2,3-b]oxirene-2-ethanol, decahydro-1a,2a,6,6-tetramethyl-, (1a.alpha.,2.beta.,2a.beta.,6a.beta.,7a.alpha.)-(.+-.)-
CAS Registry Number 131758-12-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-14(2)7-5-8-15(3)11(6-9-17)16(4)13(18-16)10-12(14)15/h11-13,17H,5-10H2,1-4H3/t11-,12-,13+,15-,16-/m1/s1
InChIKey QBQGGNGJCAJVIH-CNRIWFPOSA-N
Molecular Weight 252.398 g/mol
SMILES OCC[C@@]1([C@@]2([C@](C(C)(C)CCC2)([H])C[C@]2([C@@]1(O2)C)[H])C)[H]
SPLASH splash10-0a4i-9300000000-ef9c7636c3a384743277
Source of Spectrum H-73-1945-21
Synonyms (+-)-7.beta.,8-Epoxy-13,14,15,16-tetranor-5.beta.-labdan-12-ol 2-(2.beta.,3.beta.-epoxy-1,2,3,4,4a.beta.,5,6,7,8,8a-decahydro-5,58a.beta.-trimethyl-1.beta.-naphthyl)ethanol 2-[(1aR,2R,2aS,6aR,7aS)-1a,2a,6,6-tetramethyldecahydronaphtho[2,3-b]oxiren-2-yl]ethanol
Wiley ID 1256169
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