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Se-phenyl abieta-7,13-diene-18-selenoate
SpectraBase Compound ID FNs77lQRPcX
InChI InChI=1S/C26H34OSe/c1-18(2)19-11-13-22-20(17-19)12-14-23-25(22,3)15-8-16-26(23,4)24(27)28-21-9-6-5-7-10-21/h5-7,9-10,12,17-18,22-23H,8,11,13-16H2,1-4H3
InChIKey HFNCHZWHAVNVKD-UHFFFAOYSA-N
Mol Weight 441.5 g/mol
Molecular Formula C26H34OSe
Exact Mass 442.177488 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjlIPXtFR0g
Name Se-phenyl abieta-7,13-diene-18-selenoate
CAS Registry Number 76920-33-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34OSe
InChI InChI=1S/C26H34OSe/c1-18(2)19-11-13-22-20(17-19)12-14-23-25(22,3)15-8-16-26(23,4)24(27)28-21-9-6-5-7-10-21/h5-7,9-10,12,17-18,22-23H,8,11,13-16H2,1-4H3
InChIKey HFNCHZWHAVNVKD-UHFFFAOYSA-N
Molecular Weight 441.529 g/mol
SMILES c1ccccc1[Se]C(=O)C1(C2CC=C3C=C(CCC3C2(CCC1)C)C(C)C)C
SPLASH splash10-0a4i-3790000000-135d9cda92784613347d
Synonyms 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboselenoic acid Se-phenyl ester 1-Phenanthrenecarboselenoic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethyl)-, Se-phenyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,10a.alp 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboselenoic acid Se-phenyl ester Se-phenyl 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboselenoate Se-phenyl 7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboselenoate
Wiley ID 1489989