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Cyclotridecanepropanal, 1-nitro-2-oxo-
SpectraBase Compound ID 6DbsdhXXGNN
InChI InChI=1S/C16H27NO4/c18-14-10-13-16(17(20)21)12-9-7-5-3-1-2-4-6-8-11-15(16)19/h14H,1-13H2
InChIKey YKZCQFBBFQXMKR-UHFFFAOYSA-N
Mol Weight 297.4 g/mol
Molecular Formula C16H27NO4
Exact Mass 297.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdYQEcxxsgJ
Name Cyclotridecanepropanal, 1-nitro-2-oxo-
CAS Registry Number 91652-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO4
InChI InChI=1S/C16H27NO4/c18-14-10-13-16(17(20)21)12-9-7-5-3-1-2-4-6-8-11-15(16)19/h14H,1-13H2
InChIKey YKZCQFBBFQXMKR-UHFFFAOYSA-N
Molecular Weight 297.395 g/mol
SMILES C1(N(=O)=O)(C(=O)CCCCCCCCCCC1)CCC=O
SPLASH splash10-0apr-9000000000-89423fc5034eaacf6828
Source of Spectrum H-67-2182-0
Synonyms 3-(1-Nitro-2-oxocyclotridecyl)propanal
Wiley ID 1300099