SpectraBase Compound ID | Do8HrckoJmG |
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InChI | InChI=1S/C31H36N4/c1-4-7-8-9-10-26-27-15-13-24(33-27)19-22-11-12-23(32-22)20-25-14-16-29(34-25)31(21(5-2)6-3)30-18-17-28(26)35-30/h11-21,33-34H,4-10H2,1-3H3/b22-19-,23-20-,24-19-,25-20-,27-26-,28-26-,31-29-,31-30- |
InChIKey | WEROJHDEEUZXNL-ABIREAQOSA-N |
Mol Weight | 464.7 g/mol |
Molecular Formula | C31H36N4 |
Exact Mass | 464.293997 g/mol |
SpectraBase Spectrum ID | J5bKwHHfkeX |
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Name | 5-(1-Ethylpropyl)-10-hexylporphyrin |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C31H36N4 |
InChI | InChI=1S/C31H36N4/c1-4-7-8-9-10-26-27-15-13-24(33-27)19-22-11-12-23(32-22)20-25-14-16-29(34-25)31(21(5-2)6-3)30-18-17-28(26)35-30/h11-21,33-34H,4-10H2,1-3H3/b22-19-,23-20-,24-19-,25-20-,27-26-,28-26-,31-29-,31-30- |
InChIKey | WEROJHDEEUZXNL-ABIREAQOSA-N |
Molecular Weight | 464.657 g/mol |
SMILES | [nH]1c2ccc1c(c1nc(c(c3ccc(cc4nc(c2)cc4)[nH]3)C(CC)CC)cc1)CCCCCC |
SPLASH | splash10-01p9-0001900000-bca0e729c2d8c1b20eb7 |
Source of Spectrum | U1-2010-248-42 |
Wiley ID | 1663754 |