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Montanine
SpectraBase Compound ID 6H4EmZShTsu
InChI InChI=1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3/t12-,13-,14-,15-/m0/s1
InChIKey MKYLOMHWHWEFCT-AJNGGQMLSA-N
Mol Weight 301.34 g/mol
Molecular Formula C17H19NO4
Exact Mass 301.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rrVn7xiN6
Name Montanine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19NO4
InChI InChI=1S/C17H19NO4/c1-20-15-4-11-12-7-18(13(11)5-14(15)19)6-9-2-16-17(3-10(9)12)22-8-21-16/h2-4,12-15,19H,5-8H2,1H3/t12-,13-,14-,15-/m0/s1
InChIKey MKYLOMHWHWEFCT-AJNGGQMLSA-N
Instrument Name Agilent 7890A-Quad 7000
Ionization Type EI
Literature Reference DOI 10.1002/pca.2865
Molecular Weight 301.342 g/mol
SMILES O[C@]1(C[C@]2(C([C@@]3(c4c(cc5c(OCO5)c4)CN2C3)[H])=C[C@@]1(OC)[H])[H])[H]
SPLASH splash10-0fk9-0494000000-df370e096d08e8417645
Source of Spectrum PA-31-51-16
Wiley ID 1840309