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Ethyl (9R,9aS)-9-(Nitromethyl)-1,2,9,9a-tetrahydrocyclopenta[b]chromene-9a-carboxylate
SpectraBase Compound ID wkulKoe8Qj
InChI InChI=1S/C16H17NO5/c1-2-21-15(18)16-9-5-8-14(16)22-13-7-4-3-6-11(13)12(16)10-17(19)20/h3-4,6-8,12H,2,5,9-10H2,1H3/t12-,16+/m1/s1
InChIKey QKOMCSDINRVWQI-WBMJQRKESA-N
Mol Weight 303.31 g/mol
Molecular Formula C16H17NO5
Exact Mass 303.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NzRSi7X3zX
Name Ethyl (9R,9aS)-9-(Nitromethyl)-1,2,9,9a-tetrahydrocyclopenta[b]chromene-9a-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO5
InChI InChI=1S/C16H17NO5/c1-2-21-15(18)16-9-5-8-14(16)22-13-7-4-3-6-11(13)12(16)10-17(19)20/h3-4,6-8,12H,2,5,9-10H2,1H3/t12-,16+/m1/s1
InChIKey QKOMCSDINRVWQI-WBMJQRKESA-N
Molecular Weight 303.314 g/mol
SMILES [C@]12(C(Oc3c([C@]2(CN(=O)=O)[H])cccc3)=CCC1)C(=O)OCC
SPLASH splash10-0f89-0924000000-1644c024f30be633ed8c
Source of Spectrum F4-44-773-5f
Wiley ID 1706924