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Pentazocine
SpectraBase Compound ID EwRArfwJSTx
InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14?,18-,19-/m1/s1
InChIKey VOKSWYLNZZRQPF-JDBFWQQPSA-N
Mol Weight 285.43 g/mol
Molecular Formula C19H27NO
Exact Mass 285.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5d055rjjMsw
Name Pentazocine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO
InChI InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14?,18-,19-/m1/s1
InChIKey VOKSWYLNZZRQPF-JDBFWQQPSA-N
Molecular Weight 285.431 g/mol
SMILES Oc1cc2[C@@]3(C)C(C)[C@](N(CC3)CC=C(C)C)(Cc2cc1)[H]
SPLASH splash10-01b9-6940000000-f5c74ce75a78898c0683
Source of Spectrum SWG-33-3037-0
Synonyms Talwin 2-Dimethylallyl-5,9-dimethyl-2'-hydroxybenzomorphan (2S,6R)-6,11-dimethyl-3-(3-methylbut-2-en-1-yl)-1,2,3,4,5,6-hexahydro-2,6-methanobenzo[d]azocin-8-ol
Wiley ID 1810004