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Cyclododecanone, 2-(3-hydroxybutyl)-2-nitro-
SpectraBase Compound ID 2nBD3hwv3wv
InChI InChI=1S/C16H29NO4/c1-14(18)11-13-16(17(20)21)12-9-7-5-3-2-4-6-8-10-15(16)19/h14,18H,2-13H2,1H3
InChIKey NQCAHLNNRFBFLS-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 JJPQQlAEOFT
Name Cyclododecanone, 2-(3-hydroxybutyl)-2-nitro-
CAS Registry Number 86911-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NO4
InChI InChI=1S/C16H29NO4/c1-14(18)11-13-16(17(20)21)12-9-7-5-3-2-4-6-8-10-15(16)19/h14,18H,2-13H2,1H3
InChIKey NQCAHLNNRFBFLS-UHFFFAOYSA-N
Molecular Weight 299.411 g/mol
SMILES OC(CCC1(N(=O)=O)C(=O)CCCCCCCCCC1)C
SPLASH splash10-05o4-9100000000-e00cbfe926a042bd3a24
Source of Spectrum H-67-1722-0
Synonyms 2-(3-hydroxybutyl)-2-nitro-1-cyclododecanone 2-(3-hydroxybutyl)-2-nitrocyclododecan-1-one 2-Nitro-2-(3-oxidanylbutyl)cyclododecan-1-one
Wiley ID 1301969