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cis-2-[(E)-3,3-Dimethylbut-1-enyl]-3-nitrotetrahydropyran
SpectraBase Compound ID Jt5KKB8RxxH
InChI InChI=1S/C11H19NO3/c1-11(2,3)7-6-10-9(12(13)14)5-4-8-15-10/h6-7,9-10H,4-5,8H2,1-3H3/b7-6+/t9-,10-/m0/s1
InChIKey ROLVILGSZXWCLH-CAFLDADYSA-N
Mol Weight 213.28 g/mol
Molecular Formula C11H19NO3
Exact Mass 213.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JcRtcScblc9
Name cis-2-[(E)-3,3-Dimethylbut-1-enyl]-3-nitrotetrahydropyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19NO3
InChI InChI=1S/C11H19NO3/c1-11(2,3)7-6-10-9(12(13)14)5-4-8-15-10/h6-7,9-10H,4-5,8H2,1-3H3/b7-6+/t9-,10-/m0/s1
InChIKey ROLVILGSZXWCLH-CAFLDADYSA-N
Molecular Weight 213.277 g/mol
SMILES [C@]1(N(=O)=O)([C@](\C=C\C(C)(C)C)(OCCC1)[H])[H]
SPLASH splash10-0159-7900000000-63dd278c7b504b679f02
Source of Spectrum F-50-1875-4
Synonyms (2S,3S)-2-[(1E)-3,3-dimethyl-1-butenyl]-3-nitrotetrahydro-2H-pyran
Wiley ID 1212579