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1,3-CYCLOHEXANEDIOL, 2-METHYL-2-NITRO-, MONOACETATE (ESTER), [1S-(1alpha,2beta,3alpha)]-
SpectraBase Compound ID AelmQFXWAre
InChI InChI=1S/C9H15NO5/c1-6(11)15-8-5-3-4-7(12)9(8,2)10(13)14/h7-8,12H,3-5H2,1-2H3
InChIKey MUEQVJXMGIJSFH-UHFFFAOYSA-N
Mol Weight 217.22 g/mol
Molecular Formula C9H15NO5
Exact Mass 217.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXcLG9TV6u5
Name 1,3-CYCLOHEXANEDIOL, 2-METHYL-2-NITRO-, MONOACETATE (ESTER), [1S-(1alpha,2beta,3alpha)]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H15NO5
InChI InChI=1S/C9H15NO5/c1-6(11)15-8-5-3-4-7(12)9(8,2)10(13)14/h7-8,12H,3-5H2,1-2H3
InChIKey MUEQVJXMGIJSFH-UHFFFAOYSA-N
Molecular Weight 217.0946
SMILES OC1CCCC(OC(=O)C)C1(N(=O)=O)C
SPLASH splash10-0006-9100000000-ee705778d12e10c9967f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany