For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(6S,6aR,8R,11S)-8-methoxy-6a,7,8,11-tetrahydro-6,11-methano[1,3]dioxolo[4',5':4,5]benzo[1,2-e]benzo[b]azepin-9(5H)-one
SpectraBase Compound ID 3PksSmxWrtx
InChI InChI=1S/C17H17NO4/c1-20-15-5-13-11(3-14(15)19)12-7-18(13)6-9-2-16-17(4-10(9)12)22-8-21-16/h2-4,12-13,15H,5-8H2,1H3/t12-,13+,15+/m0/s1
InChIKey JSIYKEYCFTVWNO-GZBFAFLISA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ca9Fd5o5KaU
Name (6S,6aR,8R,11S)-8-methoxy-6a,7,8,11-tetrahydro-6,11-methano[1,3]dioxolo[4',5':4,5]benzo[1,2-e]benzo[b]azepin-9(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-20-15-5-13-11(3-14(15)19)12-7-18(13)6-9-2-16-17(4-10(9)12)22-8-21-16/h2-4,12-13,15H,5-8H2,1H3/t12-,13+,15+/m0/s1
InChIKey JSIYKEYCFTVWNO-GZBFAFLISA-N
Literature Reference DOI 10.1021/ol801815k
Molecular Weight 299.326 g/mol
SMILES C1[C@@](OC)(C(C=C2[C@]1([H])N1C[C@]2(c2c(cc3c(c2)OCO3)C1)[H])=O)[H]
SPLASH splash10-01ot-1390000000-68e2ae8b4566552a9638
Source of Spectrum A1-10-4693/SMS20-24
Wiley ID 1759932