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

*Links on SpectraBase are not permalinks.
Dimethyl 3,3'-[2-(dimethylcarbamoyl)methyl-3-ethylidene-2,7,12,18-tetramethyl-2,3-dihydro-porphyrin-13,17-diyl]-21H,23H-dipropionate
SpectraBase Compound ID D9sJu7Bahns
InChI InChI=1S/C38H45N5O5/c1-10-27-33-17-28-21(2)15-24(39-28)16-29-22(3)25(11-13-36(45)47-8)31(40-29)18-32-26(12-14-37(46)48-9)23(4)30(41-32)19-34(42-33)38(27,5)20-35(44)43(6)7/h10,15-19,40,42H,11-14,20H2,1-9H3/b24-16-,27-10+,32-18-,33-17-,34-19-/t38-/m0/s1
InChIKey VOEBSLTUNCNJON-DIYZYWHLSA-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 EPGE6RCDTm5
Name Dimethyl 3,3'-[2-(dimethylcarbamoyl)methyl-3-ethylidene-2,7,12,18-tetramethyl-2,3-dihydro-porphyrin-13,17-diyl]-21H,23H-dipropionate
CAS Registry Number 101544-04-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H45N5O5
InChI InChI=1S/C38H45N5O5/c1-10-27-33-17-28-21(2)15-24(39-28)16-29-22(3)25(11-13-36(45)47-8)31(40-29)18-32-26(12-14-37(46)48-9)23(4)30(41-32)19-34(42-33)38(27,5)20-35(44)43(6)7/h10,15-19,40,42H,11-14,20H2,1-9H3/b24-16-,27-10+,32-18-,33-17-,34-19-/t38-/m0/s1
InChIKey VOEBSLTUNCNJON-DIYZYWHLSA-N
Molecular Weight 651.808 g/mol
SMILES [nH]1c2[C@](\C(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC(=O)OC)C)c(c3C)CCC(=O)OC)cc1C)=C/C)(CC(N(C)C)=O)C
SPLASH splash10-03xr-7100392000-e715a14a6315246546cf
Source of Spectrum U-1992-330-10
Wiley ID 764036