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

*Links on SpectraBase are not permalinks.
5,10-Methano-5H-dibenzo[a,d]cyclohepten-11(10H)-one, 12-chloro-3-methoxy-, (5.alpha.,10.alpha.,12S*)-
SpectraBase Compound ID Gg0KRyyIwWB
InChI InChI=1S/C17H13ClO2/c1-20-9-6-7-12-13(8-9)14-10-4-2-3-5-11(10)15(16(14)18)17(12)19/h2-8,14-16H,1H3/t14-,15-,16-/m0/s1
InChIKey RWGBPUKIYDPRNB-JYJNAYRXSA-N
Mol Weight 284.74 g/mol
Molecular Formula C17H13ClO2
Exact Mass 284.060407 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 78Fn44qP9iB
Name 5,10-Methano-5H-dibenzo[a,d]cyclohepten-11(10H)-one, 12-chloro-3-methoxy-, (5.alpha.,10.alpha.,12S*)-
CAS Registry Number 106248-59-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13ClO2
InChI InChI=1S/C17H13ClO2/c1-20-9-6-7-12-13(8-9)14-10-4-2-3-5-11(10)15(16(14)18)17(12)19/h2-8,14-16H,1H3/t14-,15-,16-/m0/s1
InChIKey RWGBPUKIYDPRNB-JYJNAYRXSA-N
Molecular Weight 284.742 g/mol
SMILES [C@@]12(C(c3ccc(cc3[C@]([C@@]2(Cl)[H])([H])c2c1cccc2)OC)=O)[H]
SPLASH splash10-0032-0390000000-472d1ee316e196a88be0
Source of Spectrum C-109-835-26
Synonyms (1R,9S,16S)-16-chloro-4-methoxytetracyclo[7.6.1.0(2,7).0(10,15)]hexadeca-2,4,6,10,12,14-hexaen-8-one Anti-8-chloro-2,3-(10-methoxybenzo)-6,7-benzobicyclo[3.2.1]octa-2,6-diene-4-one
Wiley ID 1288006