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Shepherdine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Shepherdine
SpectraBase Compound ID BkQCTGmPS4j
InChI InChI=1S/C12H14N2O/c1-7-12-9(4-5-13-7)10-6-8(15)2-3-11(10)14-12/h2-3,6-7,13-15H,4-5H2,1H3
InChIKey GHKJDZJAHHVUTD-UHFFFAOYSA-N
Mol Weight 202.26 g/mol
Molecular Formula C12H14N2O
Exact Mass 202.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARfYeANtU5p
Name Shepherdine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O
InChI InChI=1S/C12H14N2O/c1-7-12-9(4-5-13-7)10-6-8(15)2-3-11(10)14-12/h2-3,6-7,13-15H,4-5H2,1H3
InChIKey GHKJDZJAHHVUTD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np020009+
Molecular Weight 202.257 g/mol
SMILES [nH]1c2c(CCNC2C)c2cc(ccc12)O
SPLASH splash10-03di-9410000000-803abe418bc6163c61cc
Source of Spectrum G4-65-1175-7
Wiley ID 1883798