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

*Links on SpectraBase are not permalinks.
Dimethyl 3,3'-[(8E)-7-(dimethylcarbamoyl)methyl-8-ethyl-2,7,12,18-tetramethyl-7,8-dihydro-porphyrinato-13,17-diyl]dipropionate
SpectraBase Compound ID GAvtLseCpll
InChI InChI=1S/C38H45N5O5/c1-10-27-33-18-30-23(4)26(12-14-37(46)48-9)32(41-30)19-31-25(11-13-36(45)47-8)22(3)29(40-31)17-28-21(2)15-24(39-28)16-34(42-33)38(27,5)20-35(44)43(6)7/h10,15-19,39,41H,11-14,20H2,1-9H3/b24-16-,27-10+,28-17-,29-17-,30-18-,31-19-,32-19-,33-18-,34-16-
InChIKey VOVWPDYELLFGTN-VPQBGJOSSA-N
Mol Weight 651.8 g/mol
Molecular Formula C38H45N5O5
Exact Mass 651.34207 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 Dil6rzBRptL
Name Dimethyl 3,3'-[(8E)-7-(dimethylcarbamoyl)methyl-8-ethyl-2,7,12,18-tetramethyl-7,8-dihydro-porphyrinato-13,17-diyl]dipropionate
CAS Registry Number 138608-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H45N5O5
InChI InChI=1S/C38H45N5O5/c1-10-27-33-18-30-23(4)26(12-14-37(46)48-9)32(41-30)19-31-25(11-13-36(45)47-8)22(3)29(40-31)17-28-21(2)15-24(39-28)16-34(42-33)38(27,5)20-35(44)43(6)7/h10,15-19,39,41H,11-14,20H2,1-9H3/b24-16-,27-10+,28-17-,29-17-,30-18-,31-19-,32-19-,33-18-,34-16-
InChIKey VOVWPDYELLFGTN-VPQBGJOSSA-N
Molecular Weight 651.808 g/mol
SMILES [nH]1c2c(cc1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC(=O)OC)C)c(c3C)CCC(=O)OC)\C(C1(CC(N(C)C)=O)C)=C/C)C
SPLASH splash10-014i-0000192000-7837c84b82a84c3ddc91
Source of Spectrum U-1992-332-11
Wiley ID 764031