For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,5R,7S,8R,2E,4E)-Tricarbonyl-{.eta(4).-(2->5)-8-[(t-butoxycarbonyl)amino]-7-methoxynona-2,4-diene-1-nitrile]-iron
SpectraBase Compound ID EzNX2MsrLJT
InChI InChI=1S/C15H24N2O3.3CO.Fe/c1-12(17-14(18)20-15(2,3)4)13(19-5)10-8-6-7-9-11-16;3*1-2;/h6-9,12-13H,10H2,1-5H3,(H,17,18);;;;/t12-,13+;;;;/m1..../s1
InChIKey RKGRNPRVTDOQSH-XWZLFUPLSA-N
Mol Weight 420.24 g/mol
Molecular Formula C18H24FeN2O6
Exact Mass 420.098372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Lff9d8fThcD
Name (2S,5R,7S,8R,2E,4E)-Tricarbonyl-{.eta(4).-(2->5)-8-[(t-butoxycarbonyl)amino]-7-methoxynona-2,4-diene-1-nitrile]-iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24FeN2O6
InChI InChI=1S/C15H24N2O3.3CO.Fe/c1-12(17-14(18)20-15(2,3)4)13(19-5)10-8-6-7-9-11-16;3*1-2;/h6-9,12-13H,10H2,1-5H3,(H,17,18);;;;/t12-,13+;;;;/m1..../s1
InChIKey RKGRNPRVTDOQSH-XWZLFUPLSA-N
Molecular Weight 420.243 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@]([C@](CC1[Fe]23(C(C13)C2C#N)(C#[O])(C#[O])C#[O])(OC)[H])(C)[H]
SPLASH splash10-0a4i-9002000000-2903499693f8df85f4ca
Source of Spectrum C-121-9153-20
Wiley ID 1700320