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Pyrano[3,2-j][1]benzoxepin, dodecahydro-, [4aS-(4a.alpha.,7a.beta.,12aS*)]-
SpectraBase Compound ID DbY36pqAPYv
InChI InChI=1S/C13H22O2/c1-2-9-14-13-11(5-1)6-3-7-12(13)8-4-10-15-13/h11-12H,1-10H2/t11-,12+,13-/m1/s1
InChIKey RMJWPXYASLMLAC-FRRDWIJNSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 869cD11lnzD
Name Pyrano[3,2-j][1]benzoxepin, dodecahydro-, [4aS-(4a.alpha.,7a.beta.,12aS*)]-
CAS Registry Number 131226-81-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-2-9-14-13-11(5-1)6-3-7-12(13)8-4-10-15-13/h11-12H,1-10H2/t11-,12+,13-/m1/s1
InChIKey RMJWPXYASLMLAC-FRRDWIJNSA-N
Molecular Weight 210.317 g/mol
SMILES [C@]123OCCCC[C@@]3(CCC[C@]1(CCCO2)[H])[H]
SPLASH splash10-0ik9-3920000000-d5af7a082a7869ab7cc3
Source of Spectrum F-46-4790-18
Synonyms (+)-(7S,1R,11S)-2,15-dioxatricyclo[9.4.0.0(1,7)]pentadecane (4aS,7aS,12aR)-dodecahydrooxepino[3,2-i]chromene
Wiley ID 1209614