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(S)-2-Amino-5-[naphth-1-yl]pent-4-ynoic acid-Ni-(S)-N-(benzylprolyl)aminobenzophenone
SpectraBase Compound ID EPdkS31hgMr
InChI InChI=1S/C40H35N3O3.Ni/c44-39(37-26-13-27-43(37)28-29-14-3-1-4-15-29)42-35-24-10-9-23-34(35)38(32-17-5-2-6-18-32)41-36(40(45)46)25-12-21-31-20-11-19-30-16-7-8-22-33(30)31;/h1-11,14-20,22-24,36-37H,13,25-28H2,(H2,41,42,44,45,46);/q;+2/p-2/t36-,37-;/m0./s1
InChIKey QJSANMRFXMIHAV-GVGVJZOBSA-L
Mol Weight 662.4 g/mol
Molecular Formula C40H33N3NiO3
Exact Mass 661.187534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WpkKsBiuu
Name (S)-2-Amino-5-[naphth-1-yl]pent-4-ynoic acid-Ni-(S)-N-(benzylprolyl)aminobenzophenone
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Formula C40H33N3NiO3
InChI InChI=1S/C40H35N3O3.Ni/c44-39(37-26-13-27-43(37)28-29-14-3-1-4-15-29)42-35-24-10-9-23-34(35)38(32-17-5-2-6-18-32)41-36(40(45)46)25-12-21-31-20-11-19-30-16-7-8-22-33(30)31;/h1-11,14-20,22-24,36-37H,13,25-28H2,(H2,41,42,44,45,46);/q;+2/p-2/t36-,37-;/m0./s1
InChIKey QJSANMRFXMIHAV-GVGVJZOBSA-L
Molecular Weight 662.415 g/mol
SMILES [Ni+2].c1ccc(c(c1)[N-]C(=O)[C@]1(N(CCC1)Cc1ccccc1)[H])C(=N[C@](C([O-])=O)(CC#Cc1cccc2c1cccc2)[H])c1ccccc1
SPLASH splash10-03xu-6940007000-222d92af80f0b26d9869
Source of Spectrum RSA-5-107407-2e
Synonyms Nickel(II) (benzyl-L-prolyl)(2-((((S)-1-carboxylato-4-(naphthalen-1-yl)but-3-yn-1-yl)imino)(phenyl)methyl)phenyl)amide
Wiley ID 1802768