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Vittatine
SpectraBase Compound ID 3qxw6ZOrJRA
InChI InChI=1S/C16H17NO3/c18-11-1-2-16-3-4-17(15(16)6-11)8-10-5-13-14(7-12(10)16)20-9-19-13/h1-2,5,7,11,15,18H,3-4,6,8-9H2/t11-,15+,16+/m1/s1
InChIKey RPAORVSEYNOMBR-RLCCDNCMSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFGz6g1SpHs
Name Vittatine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c18-11-1-2-16-3-4-17(15(16)6-11)8-10-5-13-14(7-12(10)16)20-9-19-13/h1-2,5,7,11,15,18H,3-4,6,8-9H2/t11-,15+,16+/m1/s1
InChIKey RPAORVSEYNOMBR-RLCCDNCMSA-N
Molecular Weight 271.316 g/mol
SMILES O[C@]1(C[C@@]2(N3Cc4c(cc5c(OCO5)c4)[C@]2(C=C1)CC3)[H])[H]
SPLASH splash10-00ds-0960000000-78df42ee83df429bde04
Source of Spectrum PA-19-415-16
Synonyms (3S,4aS,11bR)-4,4a-dihydro-3H,6H-5,11b-ethano[1,3]dioxolo[4,5-j]phenanthridin-3-ol
Wiley ID 1789569