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

*Links on SpectraBase are not permalinks.
Methyl (2R*,2aS*,6aS*)-9-Butoxyoctahydro-1,10-dioxa-10a-azacyclohex[c]indene-2-cerboxylate
SpectraBase Compound ID ImiOtuwcB9B
InChI InChI=1S/C16H27NO5/c1-3-4-11-20-13-8-10-16-9-6-5-7-12(16)14(15(18)19-2)22-17(16)21-13/h12-14H,3-11H2,1-2H3/t12-,13?,14-,16+/m1/s1
InChIKey DVCYSKZAMFBFPB-TVSIFNJZSA-N
Mol Weight 313.39 g/mol
Molecular Formula C16H27NO5
Exact Mass 313.188923 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 Dom7Nosi8LB
Name Methyl (2R*,2aS*,6aS*)-9-Butoxyoctahydro-1,10-dioxa-10a-azacyclohex[c]indene-2-cerboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO5
InChI InChI=1S/C16H27NO5/c1-3-4-11-20-13-8-10-16-9-6-5-7-12(16)14(15(18)19-2)22-17(16)21-13/h12-14H,3-11H2,1-2H3/t12-,13?,14-,16+/m1/s1
InChIKey DVCYSKZAMFBFPB-TVSIFNJZSA-N
Molecular Weight 313.394 g/mol
SMILES [C@@]1(ON2[C@]3([C@@]1(CCCC3)[H])CCC(O2)OCCCC)(C(=O)OC)[H]
SPLASH splash10-00di-0930000000-265cbc189e82b3444a2c
Source of Spectrum J-63-1615-22
Synonyms Methyl (2R*,2aS*,6aS*)-9-Butoxyoctahydro-1,10-dioxa-10a-azacyclohex[c]indene-2-carboxylate methyl (7R,7aS,11aS)-3-butoxyoctahydro-1H-[1,2]oxazino[3,2-i][2,1]benzisoxazole-7-carboxylate
Wiley ID 1314198