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1-[2-nitro-1-(3-nitrophenyl)ethyl]-3,4-dihydro-1H-naphthalen-2-one
SpectraBase Compound ID 8qJBqAdWhQ7
InChI InChI=1S/C18H16N2O5/c21-17-9-8-12-4-1-2-7-15(12)18(17)16(11-19(22)23)13-5-3-6-14(10-13)20(24)25/h1-7,10,16,18H,8-9,11H2
InChIKey SAHDSRQUGCGXHP-UHFFFAOYSA-N
Mol Weight 340.34 g/mol
Molecular Formula C18H16N2O5
Exact Mass 340.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5i74zmMQbYn
Name 1-[2-Nitro-1-(3-nitrophenyl)ethyl]-3,4-dihydro-2(1H)-naphthalenone
CAS Registry Number 87732-66-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O5
InChI InChI=1S/C18H16N2O5/c21-17-9-8-12-4-1-2-7-15(12)18(17)16(11-19(22)23)13-5-3-6-14(10-13)20(24)25/h1-7,10,16,18H,8-9,11H2
InChIKey SAHDSRQUGCGXHP-UHFFFAOYSA-N
Molecular Weight 340.335 g/mol
SMILES c1c2c(ccc1)C(C(CC2)=O)C(CN(=O)=O)c1cc(ccc1)N(=O)=O
SPLASH splash10-014i-6920000000-e9289459fe2aa0dcb618
Synonyms 1-[2-nitro-1-(3-nitrophenyl)ethyl]-3,4-dihydro-1H-naphthalen-2-one 1-[2-nitro-1-(3-nitrophenyl)ethyl]tetralin-2-one
Wiley ID 1484473