SpectraBase Spectrum ID |
JJ1mgw3KedU |
Name |
1-Phenyl-2-nitro-1-propanol |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
181.073893215 u |
Formula |
C9H11NO3 |
InChI |
InChI=1S/C9H11NO3/c1-7(10(12)13)9(11)8-5-3-2-4-6-8/h2-7,9,11H,1H3 |
InChIKey |
JGYVPZIKTZGAAD-UHFFFAOYSA-N |
Ionization Type |
Chemical Ionization (CI) |
Molecular Weight |
181.191 g/mol |
Nominal Mass |
181 u |
Reagent Gas |
Methane |
Retention Index |
1493 |
SMILES |
OC(C=1C=CC=CC1)C([N+](=O)[O-])C |
SPLASH |
splash10-066r-3900000000-ac87b6f7f2b21849cec2 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-nitro-1-phenylpropan-1-ol |
Technique |
GC/MS |
Wiley ID |
DD2024_003595 |