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

*Links on SpectraBase are not permalinks.

Jhelumine

View entire compound with spectra: 1 MS (GC)

Jhelumine
SpectraBase Compound ID HpxFwMMtiHA
InChI InChI=1S/C36H38N2O7/c1-37-13-11-25-18-34(43-4)35(41)36(28(25)20-37)45-33-19-27-24(17-32(33)42-3)12-14-38(2)29(27)15-22-5-8-26(9-6-22)44-31-16-23(21-39)7-10-30(31)40/h5-10,16-19,21,29,40-41H,11-15,20H2,1-4H3/t29-/m0/s1
InChIKey WDODEBGCNMGJJN-LJAQVGFWSA-N
Mol Weight 610.7 g/mol
Molecular Formula C36H38N2O7
Exact Mass 610.267902 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 Llk7sEZdWIe
Name Jhelumine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H38N2O7
InChI InChI=1S/C36H38N2O7/c1-37-13-11-25-18-34(43-4)35(41)36(28(25)20-37)45-33-19-27-24(17-32(33)42-3)12-14-38(2)29(27)15-22-5-8-26(9-6-22)44-31-16-23(21-39)7-10-30(31)40/h5-10,16-19,21,29,40-41H,11-15,20H2,1-4H3/t29-/m0/s1
InChIKey WDODEBGCNMGJJN-LJAQVGFWSA-N
Molecular Weight 610.707 g/mol
SMILES Oc1c(cc2c(c1Oc1cc3[C@](Cc4ccc(Oc5c(ccc(c5)C=O)O)cc4)(N(CCc3cc1OC)C)[H])CN(CC2)C)OC
SPLASH splash10-001i-0209000000-a52a2e43dbc434a87ec6
Source of Spectrum X2-50-561-262
Wiley ID 1602350