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Benzyl N-(4,4-Diethoxy-1-pentylbut-2-ynyl)carbamate
SpectraBase Compound ID 54IvM616Qz9
InChI InChI=1S/C21H31NO4/c1-4-7-9-14-19(15-16-20(24-5-2)25-6-3)22-21(23)26-17-18-12-10-8-11-13-18/h8,10-13,19-20H,4-7,9,14,17H2,1-3H3,(H,22,23)
InChIKey NQRUGPSAXMTPAB-UHFFFAOYSA-N
Mol Weight 361.48 g/mol
Molecular Formula C21H31NO4
Exact Mass 361.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3PoteMQWS8
Name Benzyl N-(4,4-Diethoxy-1-pentylbut-2-ynyl)carbamate
Alternate Name(s) benzyl 4,4-diethoxy-1-pentyl-2-butynylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO4
InChI InChI=1S/C21H31NO4/c1-4-7-9-14-19(15-16-20(24-5-2)25-6-3)22-21(23)26-17-18-12-10-8-11-13-18/h8,10-13,19-20H,4-7,9,14,17H2,1-3H3,(H,22,23)
InChIKey NQRUGPSAXMTPAB-UHFFFAOYSA-N
Molecular Weight 361.482 g/mol
SMILES N(C(=O)OCc1ccccc1)C(C#CC(OCC)OCC)CCCCC
SPLASH splash10-0006-9000000000-801024c5a77f7cea5c6b
Source of Spectrum SO-0-282-14
Wiley ID 872917