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ADB-CHMICA-M (HO-) isomer 1 MS3_1
SpectraBase Compound ID CYr4e7IJliC
InChI InChI=1S/4C16H17NO2/c18-11-13-10-17(9-12-5-2-1-3-6-12)14-7-4-8-15(19)16(13)14;18-11-13-10-17(9-12-5-2-1-3-6-12)16-14(13)7-4-8-15(16)19;18-11-13-10-17(9-12-4-2-1-3-5-12)16-7-6-14(19)8-15(13)16;18-11-13-10-17(9-12-4-2-1-3-5-12)16-8-14(19)6-7-15(13)16/h2*4,7-8,10,12H,1-3,5-6,9H2;2*6-8,10,12H,1-5,9H2/p+4
InChIKey OPJAQGDFEKGADX-UHFFFAOYSA-R
Mol Weight 256.32 g/mol
Molecular Formula C16H18NO2
Exact Mass 256.133754 g/mol
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Technique ITMS
  • MAB-CHMICA-M (HO-) isomer 1 MS3_1
  • BB-22-M (HO-) isomer 2 MS3_1
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