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N-ACETYLMIRABILIN-B
SpectraBase Compound ID 34JM8uDR25w
InChI InChI=1S/C17H25N3O/c1-4-5-6-13-10(2)9-12-7-8-14-15(12)16(13)20-17(19-14)18-11(3)21/h10,12-13H,4-9H2,1-3H3,(H,18,19,20,21)/t10-,12+,13+/m1/s1
InChIKey KHNYJODJKIAHFB-WXHSDQCUSA-N
Mol Weight 287.41 g/mol
Molecular Formula C17H25N3O
Exact Mass 287.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ATBavw3Um
Name Acetylmirabilin-B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25N3O
InChI InChI=1S/C17H25N3O/c1-4-5-6-13-10(2)9-12-7-8-14-15(12)16(13)20-17(19-14)18-11(3)21/h10,12-13H,4-9H2,1-3H3,(H,18,19,20,21)/t10-,12+,13+/m1/s1
InChIKey KHNYJODJKIAHFB-WXHSDQCUSA-N
Molecular Weight 287.407 g/mol
SMILES N(c1nc2c3c(CC[C@@]3([H])C[C@]([C@@]2(CCCC)[H])(C)[H])n1)C(=O)C
SPLASH splash10-00lr-0290000000-0b4bd695c7d44d200aaf
Source of Spectrum JA-49-767-12
Synonyms N-[(5aS,7R,8S)-8-butyl-7-methyl-4,5,5a,6,7,8-hexahydrocyclopenta[de]quinazolin-2-yl]acetamide
Wiley ID 1290942