SpectraBase Compound ID | AQgkA6QitRW |
---|---|
InChI | InChI=1S/C38H52N4O/c1-10-23-24(11-2)30-20-32-27(14-5)28(15-6)34(41-32)22-36-38(16-7,17-8)37(43-18-9)35(42-36)21-33-26(13-4)25(12-3)31(40-33)19-29(23)39-30/h19-22,37,39,42H,10-18H2,1-9H3/b31-19-,32-20-,35-21-,36-22- |
InChIKey | CEIJSOWRRBUQSS-UHYYTCLPSA-N |
Mol Weight | 580.9 g/mol |
Molecular Formula | C38H52N4O |
Exact Mass | 580.414112 g/mol |
SpectraBase Spectrum ID | HrAMoNTtqAT |
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Name | 2-Ethoxy-3,3,7,8,12,13,17,18-octaethylchlorin |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C38H52N4O |
InChI | InChI=1S/C38H52N4O/c1-10-23-24(11-2)30-20-32-27(14-5)28(15-6)34(41-32)22-36-38(16-7,17-8)37(43-18-9)35(42-36)21-33-26(13-4)25(12-3)31(40-33)19-29(23)39-30/h19-22,37,39,42H,10-18H2,1-9H3/b31-19-,32-20-,35-21-,36-22- |
InChIKey | CEIJSOWRRBUQSS-UHYYTCLPSA-N |
Molecular Weight | 580.861 g/mol |
SMILES | [nH]1c2C(C(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CC)CC)c(c3CC)CC)c(c1CC)CC)(CC)CC)OCC |
SPLASH | splash10-001i-0000090000-56d369d1031e0c93a814 |
Source of Spectrum | KC-1992-1469-8 |
Synonyms | 15-ethoxy-4,5,9,10,14,14,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,16,18(21),19-decaene 2-Ethoxy-3,3,7,8,12,13,17,18-octaethylchorin Ethyl 5,5,9,10,14,15,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(21),2,6,8(23),9,11,13,15,17,19-decaen-4-yl ether |
Wiley ID | 776543 |