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Enniatin-c

View entire compound with spectra: 1 MS (GC)

Enniatin-c
SpectraBase Compound ID BWIXTaiUfGv
InChI InChI=1S/C36H63N3O9/c1-19(2)16-25-34(43)46-29(23(9)10)32(41)38(14)27(18-21(5)6)36(45)48-30(24(11)12)33(42)39(15)26(17-20(3)4)35(44)47-28(22(7)8)31(40)37(25)13/h19-30H,16-18H2,1-15H3
InChIKey WICJNWLMJRLFKQ-UHFFFAOYSA-N
Mol Weight 681.9 g/mol
Molecular Formula C36H63N3O9
Exact Mass 681.456431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eh7nNGf8c5S
Name Enniatin-c
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H63N3O9
InChI InChI=1S/C36H63N3O9/c1-19(2)16-25-34(43)46-29(23(9)10)32(41)38(14)27(18-21(5)6)36(45)48-30(24(11)12)33(42)39(15)26(17-20(3)4)35(44)47-28(22(7)8)31(40)37(25)13/h19-30H,16-18H2,1-15H3
InChIKey WICJNWLMJRLFKQ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 681.912 g/mol
SMILES CN1C(=O)C(OC(C(N(C(C(OC(C(N(C(C(OC(C1CC(C)C)=O)C(C)C)=O)C)CC(C)C)=O)C(C)C)=O)C)CC(C)C)=O)C(C)C
SPLASH splash10-0gx0-3951123000-b05c589cc04a635c1120
Source of Spectrum SRH-2022-153-0
Wiley ID 1822680