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7-Acetoxy-2,3,4,4a,5,6,7,9a-octahydro-(4a.alpha.,7.alpha.,9a.alpha.)-cyclohepta[b]pyran
SpectraBase Compound ID 3c2Rgf5ZE4N
InChI InChI=1S/C12H18O3/c1-9(13)15-11-5-4-10-3-2-8-14-12(10)7-6-11/h6-7,10-12H,2-5,8H2,1H3/t10-,11-,12+/m1/s1
InChIKey OKMPUSRTFWNZKU-UTUOFQBUSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lyCxVVyLlV
Name 7-Acetoxy-2,3,4,4a,5,6,7,9a-octahydro-(4a.alpha.,7.alpha.,9a.alpha.)-cyclohepta[b]pyran
CAS Registry Number 141612-44-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-9(13)15-11-5-4-10-3-2-8-14-12(10)7-6-11/h6-7,10-12H,2-5,8H2,1H3/t10-,11-,12+/m1/s1
InChIKey OKMPUSRTFWNZKU-UTUOFQBUSA-N
Molecular Weight 210.273 g/mol
SMILES C1=C[C@](OC(=O)C)(CC[C@@]2([C@]1(OCCC2)[H])[H])[H]
SPLASH splash10-0f6x-9800000000-47a11aacf3eb4f33afe8
Source of Spectrum C-114-6379-16
Synonyms (4aR,7R,9aR)-2,3,4,4a,5,6,7,9a-octahydrocyclohepta[b]pyran-7-yl acetate
Wiley ID 1209305