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4,11-Epoxycycloocta[4',5']benzo[1',2':3,4]cyclobuta[1,2-c]furan-1,3-dione, 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydro-, (3a.alpha.,3b.beta.,4.alpha.,11.alpha.,11a.beta.,11b.alpha.)-
SpectraBase Compound ID 14LlR9jaLI1
InChI InChI=1S/C16H18O4/c17-15-11-9-10(12(11)16(18)20-15)14-8-6-4-2-1-3-5-7(8)13(9)19-14/h9-14H,1-6H2/t9-,10+,11+,12-,13-,14+
InChIKey GRUSPMPNICCCFL-XUYNTYLMSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1Y63jTXUUk
Name 4,11-Epoxycycloocta[4',5']benzo[1',2':3,4]cyclobuta[1,2-c]furan-1,3-dione, 3a,3b,4,5,6,7,8,9,10,11,11a,11b-dodecahydro-, (3a.alpha.,3b.beta.,4.alpha.,11.alpha.,11a.beta.,11b.alpha.)-
CAS Registry Number 106710-80-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c17-15-11-9-10(12(11)16(18)20-15)14-8-6-4-2-1-3-5-7(8)13(9)19-14/h9-14H,1-6H2/t9-,10+,11+,12-,13-,14+
InChIKey GRUSPMPNICCCFL-XUYNTYLMSA-N
Molecular Weight 274.316 g/mol
SMILES [C@@]12([C@@]3([C@]4(C(OC([C@]4([C@]3([H])[C@@](O1)([H])C1=C2CCCCCC1)[H])=O)=O)[H])[H])[H]
SPLASH splash10-0udi-0910000000-d577cf5fda7a45d7adbb
Source of Spectrum K-120-774-4
Synonyms (1R,10S,11R,12S,16R,17S)-14,18-dioxapentacyclo[8.7.1.0(2,9).0(11,17).0(12,16)]octadec-2(9)-ene-13,15-dione
Wiley ID 1278232