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2-(1-Butyl-2-nitro-2-propenyl)cyclopentanone
SpectraBase Compound ID FHGPeGu5QeG
InChI InChI=1S/C12H19NO3/c1-3-4-6-10(9(2)13(15)16)11-7-5-8-12(11)14/h10-11H,2-8H2,1H3
InChIKey YPJDTARVYZILMW-UHFFFAOYSA-N
Mol Weight 225.29 g/mol
Molecular Formula C12H19NO3
Exact Mass 225.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TALt6rmY3h
Name 2-(1-Butyl-2-nitro-2-propenyl)cyclopentanone
CAS Registry Number 104313-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO3
InChI InChI=1S/C12H19NO3/c1-3-4-6-10(9(2)13(15)16)11-7-5-8-12(11)14/h10-11H,2-8H2,1H3
InChIKey YPJDTARVYZILMW-UHFFFAOYSA-N
Molecular Weight 225.288 g/mol
SMILES C=C(C(C1CCCC1=O)CCCC)N(=O)=O
SPLASH splash10-005c-9200000000-21857c0fc445c310c005
Synonyms 2-(1-butyl-2-nitro-allyl)cyclopentanone 2-(2-nitrohept-1-en-3-yl)-1-cyclopentanone 2-(2-nitrohept-1-en-3-yl)cyclopentan-1-one 2-[1-(1-Nitrovinyl)pentyl]cyclopentanone Cyclopentanone, 2-(1-butyl-2-nitro-2-propenyl)-
Wiley ID 1484612