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Azacyclohexadecan-2-one, 13-nitro-1-(phenylmethyl)-
SpectraBase Compound ID EUM2CPgZrsr
InChI InChI=1S/C22H34N2O3/c25-22-17-11-6-4-2-1-3-5-10-15-21(24(26)27)16-12-18-23(22)19-20-13-8-7-9-14-20/h7-9,13-14,21H,1-6,10-12,15-19H2
InChIKey KSLBXIZHIXOQTF-UHFFFAOYSA-N
Mol Weight 374.5 g/mol
Molecular Formula C22H34N2O3
Exact Mass 374.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlxECgOtvIk
Name Azacyclohexadecan-2-one, 13-nitro-1-(phenylmethyl)-
Alternate Name(s) 1-Benzyl-13-nitroazacyclohexadecan-2-one N-Benzyl-12-nitro-15-pentadecanlactam
CAS Registry Number 99379-67-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34N2O3
InChI InChI=1S/C22H34N2O3/c25-22-17-11-6-4-2-1-3-5-10-15-21(24(26)27)16-12-18-23(22)19-20-13-8-7-9-14-20/h7-9,13-14,21H,1-6,10-12,15-19H2
InChIKey KSLBXIZHIXOQTF-UHFFFAOYSA-N
Molecular Weight 374.525 g/mol
SMILES C1(N(=O)=O)CCCN(C(=O)CCCCCCCCCC1)Cc1ccccc1
SPLASH splash10-002f-9415000000-adaa189004049788ff3f
Source of Spectrum H-68-490-22
Wiley ID 1356779