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N,o(34)-Dimethyl-N'-acetyl-aphelandrin
SpectraBase Compound ID BpcqDhh51bE
InChI InChI=1S/C32H42N4O5/c1-22(37)35-16-4-5-17-36-18-6-14-33-29(38)21-27(34(2)15-7-19-35)24-10-13-28-26(20-24)30(32(36)39)31(41-28)23-8-11-25(40-3)12-9-23/h8-13,20,27,30-31H,4-7,14-19,21H2,1-3H3,(H,33,38)
InChIKey ZXWQPNOAWDQENV-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C32H42N4O5
Exact Mass 562.31552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KblAgNUC70B
Name N,o(34)-Dimethyl-N'-acetyl-aphelandrin
CAS Registry Number 69744-53-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42N4O5
InChI InChI=1S/C32H42N4O5/c1-22(37)35-16-4-5-17-36-18-6-14-33-29(38)21-27(34(2)15-7-19-35)24-10-13-28-26(20-24)30(32(36)39)31(41-28)23-8-11-25(40-3)12-9-23/h8-13,20,27,30-31H,4-7,14-19,21H2,1-3H3,(H,33,38)
InChIKey ZXWQPNOAWDQENV-UHFFFAOYSA-N
Molecular Weight 562.711 g/mol
SMILES N1C(CC2c3ccc4c(C(C(N(CCC1)CCCCN(CCCN2C)C(=O)C)=O)C(O4)c1ccc(cc1)OC)c3)=O
SPLASH splash10-03xs-3760290000-506eda0924db9a94d9e3
Source of Spectrum H-61-2661-0
Wiley ID 1406951