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Heptyl 3-nitrophenylcarbamate
SpectraBase Compound ID JPmSA5TtNSx
InChI InChI=1S/C14H20N2O4/c1-2-3-4-5-6-10-20-14(17)15-12-8-7-9-13(11-12)16(18)19/h7-9,11H,2-6,10H2,1H3,(H,15,17)
InChIKey QUMQINZRAKJMTM-UHFFFAOYSA-N
Mol Weight 280.32 g/mol
Molecular Formula C14H20N2O4
Exact Mass 280.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7elV5DEgMU
Name Heptyl 3-nitrophenylcarbamate
Alternate Name(s) Carbamic acid, N-(3-nitrophenyl)-, heptyl ester Heptyl N-(3-nitrophenyl)carbamate m-Nitro carbanilic acid, n-heptyl ester N-(3-nitrophenyl)carbamic acid heptyl ester
CAS Registry Number 93896-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20N2O4
InChI InChI=1S/C14H20N2O4/c1-2-3-4-5-6-10-20-14(17)15-12-8-7-9-13(11-12)16(18)19/h7-9,11H,2-6,10H2,1H3,(H,15,17)
InChIKey QUMQINZRAKJMTM-UHFFFAOYSA-N
Molecular Weight 280.324 g/mol
SMILES N(C(=O)OCCCCCCC)c1cc(N(=O)=O)ccc1
SPLASH splash10-052f-9100000000-d94357c324b74bf14edd
Source of Spectrum AD-0-2532-0
Wiley ID 1419711