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Tetrahydroberberine-cyanoborane
SpectraBase Compound ID FvgpBVvpkop
InChI InChI=1S/C21H23BN2O4/c1-25-18-4-3-13-7-17-15-9-20-19(27-12-28-20)8-14(15)5-6-24(17,22-11-23)10-16(13)21(18)26-2/h3-4,8-9,17H,5-7,10,12,22H2,1-2H3
InChIKey ZHYJYMDQZRDRFV-UHFFFAOYSA-N
Mol Weight 376.2 g/mol
Molecular Formula C21H21BN2O4
Exact Mass 376.159437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60CPxAoJC6b
Name Tetrahydroberberine-cyanoborane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23BN2O4
InChI InChI=1S/C21H23BN2O4/c1-25-18-4-3-13-7-17-15-9-20-19(27-12-28-20)8-14(15)5-6-24(17,22-11-23)10-16(13)21(18)26-2/h3-4,8-9,17H,5-7,10,12,22H2,1-2H3
InChIKey ZHYJYMDQZRDRFV-UHFFFAOYSA-N
Molecular Weight 376.219 g/mol
SMILES c1c2c(cc3c1C1Cc4c(C[N+]1(CC3)[B-]C#N)c(c(cc4)OC)OC)OCO2
SPLASH splash10-01p9-0809000000-11bbd88f82af0d183292
Source of Spectrum APC-319-701-13
Wiley ID 1788298