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Haliclonacyclamine B
SpectraBase Compound ID 3EsnFrm8K1F
InChI InChI=1S/C32H56N2/c1-2-5-10-14-18-23-34-26-29-19-15-11-7-4-6-9-13-17-22-33-24-21-32(31(25-29)28-34)30(27-33)20-16-12-8-3-1/h4,6,8,12,29-32H,1-3,5,7,9-11,13-28H2/b6-4-,12-8+/t29-,30+,31+,32-/m0/s1
InChIKey NJJKGPKLDNEHBE-QXNQLWGDSA-N
Mol Weight 468.8 g/mol
Molecular Formula C32H56N2
Exact Mass 468.44435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQrwmC5kQ5K
Name Haliclonacyclamine B
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H56N2
InChI InChI=1S/C32H56N2/c1-2-5-10-14-18-23-34-26-29-19-15-11-7-4-6-9-13-17-22-33-24-21-32(31(25-29)28-34)30(27-33)20-16-12-8-3-1/h4,6,8,12,29-32H,1-3,5,7,9-11,13-28H2/b6-4-,12-8+/t29-,30+,31+,32-/m0/s1
InChIKey NJJKGPKLDNEHBE-QXNQLWGDSA-N
Molecular Weight 468.814 g/mol
SMILES [C@@]12([C@@]3([C@]4(CN(CC3)CCCC\C=C/CCCC[C@](CN(C1)CCCCCCCC\C=C\CC4)(C2)[H])[H])[H])[H]
SPLASH splash10-014i-0000900000-0598da1c181f636491db
Source of Spectrum F-52-9117-2
Synonyms (12S,14S,29S,30S)-1,16-diazatetracyclo[27.3.1.1(12,16).0(14,30)]tetratriaconta-6,23-diene
Wiley ID 797350