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Cyclododecanone, 2-(4-hydroxybutyl)-2-nitro-
SpectraBase Compound ID IGFyU6KFQZN
InChI InChI=1S/C16H29NO4/c18-14-10-9-13-16(17(20)21)12-8-6-4-2-1-3-5-7-11-15(16)19/h18H,1-14H2
InChIKey AGMVJUZJYJRFHV-UHFFFAOYSA-N
Mol Weight 299.41 g/mol
Molecular Formula C16H29NO4
Exact Mass 299.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AWzAWInQqbq
Name Cyclododecanone, 2-(4-hydroxybutyl)-2-nitro-
Alternate Name(s) 2-(4-Hydroxybutyl)-2-nitrocyclodecanone 2-(4-hydroxybutyl)-2-nitrocyclododecanone
CAS Registry Number 109797-08-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NO4
InChI InChI=1S/C16H29NO4/c18-14-10-9-13-16(17(20)21)12-8-6-4-2-1-3-5-7-11-15(16)19/h18H,1-14H2
InChIKey AGMVJUZJYJRFHV-UHFFFAOYSA-N
Molecular Weight 299.411 g/mol
SMILES OCCCCC1(N(=O)=O)C(=O)CCCCCCCCCC1
SPLASH splash10-05mo-9000000000-63a8967836021f7f3ef6
Source of Spectrum H-69-1618-5
Wiley ID 1301973