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Pentazocine artifact (+H2O) AC6
SpectraBase Compound ID K5id5rk3trD
InChI InChI=1S/C21H31NO3/c1-14-19-12-16-6-7-17(25-15(2)23)13-18(16)21(14,5)9-11-22(19)10-8-20(3,4)24/h6-7,13-14,19,24H,8-12H2,1-5H3
InChIKey XFJWWFGPEBFWQD-UHFFFAOYSA-N
Mol Weight 345.48 g/mol
Molecular Formula C21H31NO3
Exact Mass 345.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4b1vrXKQLs
Name HYDROXYPENTAZOCINE (METABOLITE 4 ACETYL)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H31NO3
InChI InChI=1S/C21H31NO3/c1-14-19-12-16-6-7-17(25-15(2)23)13-18(16)21(14,5)9-11-22(19)10-8-20(3,4)24/h6-7,13-14,19,24H,8-12H2,1-5H3
InChIKey XFJWWFGPEBFWQD-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 345.483 g/mol
SMILES OC(C)(C)CCN1CCC2(C)c3cc(OC(=O)C)ccc3CC1C2C
SPLASH splash10-00di-6291000000-0a6e8ae32ab9fb403c25
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany