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6:7-Benzoanellated 4-oxaspiro[2.5]octane-trans-1,2-dicarbonitrile

View entire compound with spectra: 1 MS (GC)

6:7-Benzoanellated 4-oxaspiro[2.5]octane-trans-1,2-dicarbonitrile
SpectraBase Compound ID 2Ak6DX8tGTV
InChI InChI=1S/C17H14N2O5/c18-9-13-14(10-19)15(13)16(20-5-6-21-16)11-3-1-2-4-12(11)17(24-15)22-7-8-23-17/h1-4,13-14H,5-8H2/t13-,14-/m0/s1
InChIKey HXHYEOWMNFBSGS-KBPBESRZSA-N
Mol Weight 326.31 g/mol
Molecular Formula C17H14N2O5
Exact Mass 326.090272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8f43dfPefVY
Name 6:7-Benzoanellated 4-oxaspiro[2.5]octane-trans-1,2-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O5
InChI InChI=1S/C17H14N2O5/c18-9-13-14(10-19)15(13)16(20-5-6-21-16)11-3-1-2-4-12(11)17(24-15)22-7-8-23-17/h1-4,13-14H,5-8H2/t13-,14-/m0/s1
InChIKey HXHYEOWMNFBSGS-KBPBESRZSA-N
Molecular Weight 326.308 g/mol
SMILES C12(C3(c4ccccc4C4(O2)OCCO4)OCCO3)[C@@](C#N)([C@@]1(C#N)[H])[H]
SPLASH splash10-0002-0920000000-b322d5b5010533872124
Source of Spectrum U1-2002-2389-15
Wiley ID 1522856