For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(5R,6S,7R,8R)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carbohydrazide

View entire compound with spectra: 1 MS (GC)

(5R,6S,7R,8R)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carbohydrazide
SpectraBase Compound ID IbcudTdebuL
InChI InChI=1S/C22H26N2O8/c1-28-16-4-10(5-17(29-2)21(16)30-3)18-11-6-14-15(32-9-31-14)7-12(11)20(26)13(8-25)19(18)22(27)24-23/h4-7,13,18-20,25-26H,8-9,23H2,1-3H3,(H,24,27)/t13-,18+,19+,20-/m0/s1
InChIKey ZCEIRDQCMJGVDA-HAEOHBJNSA-N
Mol Weight 446.46 g/mol
Molecular Formula C22H26N2O8
Exact Mass 446.168916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1Rqk9Yi226c
Name (5R,6S,7R,8R)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carbohydrazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O8
InChI InChI=1S/C22H26N2O8/c1-28-16-4-10(5-17(29-2)21(16)30-3)18-11-6-14-15(32-9-31-14)7-12(11)20(26)13(8-25)19(18)22(27)24-23/h4-7,13,18-20,25-26H,8-9,23H2,1-3H3,(H,24,27)/t13-,18+,19+,20-/m0/s1
InChIKey ZCEIRDQCMJGVDA-HAEOHBJNSA-N
Molecular Weight 446.456 g/mol
SMILES N(C([C@]1([C@@](c2c([C@@]([C@]1(CO)[H])(O)[H])cc1c(c2)OCO1)(c1cc(c(c(c1)OC)OC)OC)[H])[H])=O)N
SPLASH splash10-01ot-0019000000-26f4f6980a8b2c52e9fe
Source of Spectrum SI-4-36-8
Synonyms (5R,6S,7R,8R)-8-hydroxy-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydronaphtho[2,3-d][1,3]dioxole-6-carbohydrazide
Wiley ID 1813347