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7-O-acetyl-stychnovoline
SpectraBase Compound ID 5aYtq08fO4d
InChI InChI=1S/C13H17NO5/c1-6-10(19-7(2)15)4-8-9(13(17)18-3)5-14-12(16)11(6)8/h5-6,8,10-11H,4H2,1-3H3,(H,14,16)/t6-,8+,10-,11+/m0/s1
InChIKey CCQYHPKBPFYGEX-BLMCLJNJSA-N
Mol Weight 267.28 g/mol
Molecular Formula C13H17NO5
Exact Mass 267.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fko4gBMzp1I
Name 7-O-acetyl-stychnovoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO5
InChI InChI=1S/C13H17NO5/c1-6-10(19-7(2)15)4-8-9(13(17)18-3)5-14-12(16)11(6)8/h5-6,8,10-11H,4H2,1-3H3,(H,14,16)/t6-,8+,10-,11+/m0/s1
InChIKey CCQYHPKBPFYGEX-BLMCLJNJSA-N
Molecular Weight 267.281 g/mol
SMILES N1C([C@]2([C@@](C(=C1)C(=O)OC)(C[C@@]([C@@]2(C)[H])(OC(=O)C)[H])[H])[H])=O
SPLASH splash10-0006-9630000000-bc8ebb20d41154490db8
Source of Spectrum X2-48-91-9
Wiley ID 1601618