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METHYL-12-O-PODOCARPATE

View entire compound with spectra: 3 NMR, 2 FTIR, and 1 MS (GC)

METHYL-12-O-PODOCARPATE
SpectraBase Compound ID AmnEVcUH0H2
InChI InChI=1S/C19H26O3/c1-18-10-5-11-19(2,17(20)22-4)16(18)9-7-13-6-8-14(21-3)12-15(13)18/h6,8,12,16H,5,7,9-11H2,1-4H3/t16-,18-,19+/m1/s1
InChIKey BSKWXDWRTACMCC-QRQLOZEOSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ByQOQnJ9tR
Name (1S,4aS,10aR)-6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid methyl ester
Alternate Name(s) Methyl (1S,4aS,10aR)-6-methoxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
CAS Registry Number 41437-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-18-10-5-11-19(2,17(20)22-4)16(18)9-7-13-6-8-14(21-3)12-15(13)18/h6,8,12,16H,5,7,9-11H2,1-4H3/t16-,18-,19+/m1/s1
InChIKey BSKWXDWRTACMCC-QRQLOZEOSA-N
Molecular Weight 302.414 g/mol
SMILES [C@@]12([C@]([C@](C(=O)OC)(C)CCC2)(CCc2c1cc(cc2)OC)[H])C
SPLASH splash10-0fb9-1697000000-999a5578748edcdc94ee
Source of Spectrum J-55-3954-2
Wiley ID 1304992