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MBDB
SpectraBase Compound ID DWysaBDalo7
InChI InChI=1S/C12H17NO2/c1-3-10(13-2)6-9-4-5-11-12(7-9)15-8-14-11/h4-5,7,10,13H,3,6,8H2,1-2H3
InChIKey USWVWJSAJAEEHQ-UHFFFAOYSA-N
Mol Weight 207.27 g/mol
Molecular Formula C12H17NO2
Exact Mass 207.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JvEWVAPpCT
Name MBDB
Catalog Number 14218
CAS Registry Number 128767-12-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO2
InChI InChI=1S/C12H17NO2/c1-3-10(13-2)6-9-4-5-11-12(7-9)15-8-14-11/h4-5,7,10,13H,3,6,8H2,1-2H3
InChIKey USWVWJSAJAEEHQ-UHFFFAOYSA-N
Molecular Weight 207.273 g/mol
SMILES N(C(Cc1ccc2c(c1)OCO2)CC)C
SPLASH splash10-00di-9100000000-10eac510d8faa62e8761
Source of Spectrum CAY-2023-1622-0
Wiley ID 1889559