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Velucryptine

View entire compound with spectra: 1 MS (GC)

Velucryptine
SpectraBase Compound ID BISAugAOSba
InChI InChI=1S/C18H17NO4/c1-22-13-5-3-11(4-6-13)18(21)17-14-10-15(20)16(23-2)9-12(14)7-8-19-17/h3-6,9-10,20H,7-8H2,1-2H3
InChIKey ASTOIWBYEXCYLL-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fxxy8RqTnOi
Name Velucryptine
Alternate Name(s) (6-methoxy-7-oxidanyl-3,4-dihydroisoquinolin-1-yl)-(4-methoxyphenyl)methanone (7-hydroxy-6-methoxy-3,4-dihydroisoquinolin-1-yl)-(4-methoxyphenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-22-13-5-3-11(4-6-13)18(21)17-14-10-15(20)16(23-2)9-12(14)7-8-19-17/h3-6,9-10,20H,7-8H2,1-2H3
InChIKey ASTOIWBYEXCYLL-UHFFFAOYSA-N
Molecular Weight 311.337 g/mol
SMILES Oc1c(cc2CCN=C(c2c1)C(c1ccc(cc1)OC)=O)OC
SPLASH splash10-000i-0963000000-1b765943108930944bf7
Source of Spectrum X2-52-519-2
Wiley ID 1603079