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(+-)-9-(3,5-dinitrobenzoyloxy)-2,3,6,7-tetramethyl-1,4,4.alpha.,5,8,8a.beta.9.beta.,9a.beta.,10,10a.beta.-decahydroanthracene
SpectraBase Compound ID 6Tyd3mrRaBR
InChI InChI=1S/C25H30N2O6/c1-13-5-17-9-18-6-14(2)16(4)8-23(18)24(22(17)7-15(13)3)33-25(28)19-10-20(26(29)30)12-21(11-19)27(31)32/h10-12,17-18,22-24H,5-9H2,1-4H3
InChIKey UDTZNLBCPNQKNH-UHFFFAOYSA-N
Mol Weight 454.52 g/mol
Molecular Formula C25H30N2O6
Exact Mass 454.210387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8oZm2X4jEhx
Name (+-)-9-(3,5-dinitrobenzoyloxy)-2,3,6,7-tetramethyl-1,4,4.alpha.,5,8,8a.beta.9.beta.,9a.beta.,10,10a.beta.-decahydroanthracene
Alternate Name(s) 2,3,6,7-tetramethyl-1,4,4a,5,8,8a,9,9a,10,10a-decahydro-9-anthracenyl 3,5-dinitrobenzoate
CAS Registry Number 125219-18-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N2O6
InChI InChI=1S/C25H30N2O6/c1-13-5-17-9-18-6-14(2)16(4)8-23(18)24(22(17)7-15(13)3)33-25(28)19-10-20(26(29)30)12-21(11-19)27(31)32/h10-12,17-18,22-24H,5-9H2,1-4H3
InChIKey UDTZNLBCPNQKNH-UHFFFAOYSA-N
Molecular Weight 454.523 g/mol
SMILES C1(C2C(CC(=C(C2)C)C)CC2C1CC(=C(C)C2)C)OC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=O
SPLASH splash10-006x-4920000000-96633ee891ffa6e8baac
Source of Spectrum B-42-537-12
Wiley ID 1388771