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(3S,4R)-6-Methyl-3-(2-methylprop-1-en-1-yl)-4-(nitromethyl)chroman
SpectraBase Compound ID 6j9QBF6A53
InChI InChI=1S/C15H19NO3/c1-10(2)6-12-9-19-15-5-4-11(3)7-13(15)14(12)8-16(17)18/h4-7,12,14H,8-9H2,1-3H3/t12-,14-/m1/s1
InChIKey DKADBOIHXQITRU-TZMCWYRMSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1N0iQuzfS5C
Name (3S,4R)-6-Methyl-3-(2-methylprop-1-en-1-yl)-4-(nitromethyl)chroman
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c1-10(2)6-12-9-19-15-5-4-11(3)7-13(15)14(12)8-16(17)18/h4-7,12,14H,8-9H2,1-3H3/t12-,14-/m1/s1
InChIKey DKADBOIHXQITRU-TZMCWYRMSA-N
Literature Reference DOI 10.1002/asia.201100320
Molecular Weight 261.321 g/mol
SMILES C1[C@]([C@](c2cc(ccc2O1)C)(C[N+](=O)[O-])[H])(C=C(C)C)[H]
SPLASH splash10-00l2-8920000000-d2fec7fbf69fcc829777
Source of Spectrum CAJ-6-2255/SM3-6c
Wiley ID 1773078