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Amorphane <cis-4,10-epoxy->
SpectraBase Compound ID 1jtoDI4FFeI
InChI InChI=1S/C15H26O/c1-10(2)11-5-8-15(4)13-6-7-14(3,16-15)9-12(11)13/h10-13H,5-9H2,1-4H3/t11-,12-,13+,14-,15+/m0/s1
InChIKey GRFWMFZRMJAPKB-SBJFKYEJSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16m7yT0oINA
Name Amorphane
CAS Registry Number 178737-43-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 222.198365456 u
Formula C15H26O
InChI InChI=1S/C15H26O/c1-10(2)11-5-8-15(4)13-6-7-14(3,16-15)9-12(11)13/h10-13H,5-9H2,1-4H3/t11-,12-,13+,14-,15+/m0/s1
InChIKey GRFWMFZRMJAPKB-SBJFKYEJSA-N
Molecular Weight 222.372 g/mol
Number of Peaks 50
RI1 1480
SMILES C1[C@]2(C[C@]3([C@@](CC[C@@]([C@@]3(C1)[H])(C)O2)(C(C)C)[H])[H])C
SPLASH splash10-0006-9610000000-280e6bb40dde2340ab5d
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2,5-methano-2H-1-benzopyran, octahydro-2,8a-dimethyl-6-(1-methylethyl)-, (2R,4aS,5S,6S,8aR)-
Wiley ID LM_FFNSC3_2597