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ANGUSTINE
SpectraBase Compound ID 3sOYu2PxynJ
InChI InChI=1S/C20H15N3O/c1-2-12-10-21-11-16-15(12)9-18-19-14(7-8-23(18)20(16)24)13-5-3-4-6-17(13)22-19/h2-6,9-11,22H,1,7-8H2
InChIKey FACXQEOSOVJIPD-UHFFFAOYSA-N
Mol Weight 313.36 g/mol
Molecular Formula C20H15N3O
Exact Mass 313.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3JEx2gHdKB
Name 1-Vinyl-8,13-dihydro-7H-2,7-naphthyridino[3,2-a]$b-carbolin-5-one
Alternate Name(s) Angustine
CAS Registry Number 40041-96-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15N3O
InChI InChI=1S/C20H15N3O/c1-2-12-10-21-11-16-15(12)9-18-19-14(7-8-23(18)20(16)24)13-5-3-4-6-17(13)22-19/h2-6,9-11,22H,1,7-8H2
InChIKey FACXQEOSOVJIPD-UHFFFAOYSA-N
Molecular Weight 313.360 g/mol
SMILES [nH]1c2ccccc2c2CCN3C(c12)=Cc1c(C3=O)cncc1C=C
SPLASH splash10-03di-0119000000-e7709a42a0b3241c4741
Source of Spectrum F-45-2548-5
Wiley ID 1314410