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HILDAEMTHLXYCS-HEBMYIDGSA-N
SpectraBase Compound ID 1em2nd714y3
InChI InChI=1S/C27H31N3/c1-20-11-15-23(16-12-20)28-26-29(27(3,4)5)19-25(22-9-7-6-8-10-22)30(26)24-17-13-21(2)14-18-24/h6-18,25H,19H2,1-5H3/b28-26+/t25-/m1/s1
InChIKey HILDAEMTHLXYCS-HEBMYIDGSA-N
Mol Weight 397.57 g/mol
Molecular Formula C27H31N3
Exact Mass 397.251798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DmufE2PbuzX
Name HILDAEMTHLXYCS-HEBMYIDGSA-N
CAS Registry Number 136912-55-5
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H31N3
InChI InChI=1S/C27H31N3/c1-20-11-15-23(16-12-20)28-26-29(27(3,4)5)19-25(22-9-7-6-8-10-22)30(26)24-17-13-21(2)14-18-24/h6-18,25H,19H2,1-5H3/b28-26+/t25-/m1/s1
InChIKey HILDAEMTHLXYCS-HEBMYIDGSA-N
Literature Reference Author J.O.BAEG,H.ALPER
Literature Reference Citation J.ORG.CHEM.,57,157(1992)
Literature Reference DOI 10.1021/jo00027a030
Molecular Weight 397.563 g/mol
Solvent Unknown
Source File Reference UWCS2562