SpectraBase Spectrum ID |
JQfCnYhaz5C |
Name |
1-Nitronaphthalene |
CAS Registry Number |
86-57-7 |
Classification |
Explosive |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
173.047678467 u |
Formula |
C10H7NO2 |
InChI |
InChI=1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H |
InChIKey |
RJKGJBPXVHTNJL-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
173.171 g/mol |
Nominal Mass |
173 u |
Quality |
993 |
Retention Index |
1372 |
SMILES |
C=12C([N+](=O)[O-])=CC=CC2=CC=CC1 |
SPLASH |
splash10-00or-3900000000-0887f30958fdc0730a71 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-Nitronaphthalin |
Technique |
GC/MS |
Wiley ID |
DD2024_003246 |