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N(a)-demethyl-semperviaminone
SpectraBase Compound ID 7fsCa4E5CrY
InChI InChI=1S/C25H37NO/c1-16(27)19-12-14-25(5)21-9-8-20-17(7-10-22(26-6)23(20,2)3)15-18(21)11-13-24(19,25)4/h7,11-12,20-22,26H,8-10,13-15H2,1-6H3/t20-,21-,22+,24-,25-/m1/s1
InChIKey ZISLXYPNMCQAMV-NBZDVZLHSA-N
Mol Weight 367.6 g/mol
Molecular Formula C25H37NO
Exact Mass 367.287515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXNSVh2Bitu
Name N(a)-demethyl-semperviaminone
Alternate Name(s) 3.beta.-(Methylamino)-20-oxo-9,10-seco-buxa-9(11),1(10),16(17)-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H37NO
InChI InChI=1S/C25H37NO/c1-16(27)19-12-14-25(5)21-9-8-20-17(7-10-22(26-6)23(20,2)3)15-18(21)11-13-24(19,25)4/h7,11-12,20-22,26H,8-10,13-15H2,1-6H3/t20-,21-,22+,24-,25-/m1/s1
InChIKey ZISLXYPNMCQAMV-NBZDVZLHSA-N
Molecular Weight 367.577 g/mol
SMILES N([C@@]1(C([C@@]2(CC[C@]3([C@@]4([C@@](C(=CC4)C(=O)C)(CC=C3CC2=CC1)C)C)[H])[H])(C)C)[H])C
SPLASH splash10-0002-9305000000-b0fb16474db3bbd17c0a
Source of Spectrum G4-60-774-3
Wiley ID 1606802