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Nitrous acid, 3-(phenyl-2,6-D2)propyl ester
SpectraBase Compound ID DXmG19aaYqM
InChI InChI=1S/C9H11NO2/c11-10-12-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i5D,6D
InChIKey FYUBBQDVMDPQED-KCZCTXNHSA-N
Mol Weight 167.2 g/mol
Molecular Formula C9H9D2NO2
Exact Mass 167.091532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6sMUmimekl
Name Nitrous acid, 3-(phenyl-2,6-D2)propyl ester
Alternate Name(s) ortho-D2-3-Phenylpropyl nitrite
CAS Registry Number 54410-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9D2NO2
InChI InChI=1S/C9H11NO2/c11-10-12-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2/i5D,6D
InChIKey FYUBBQDVMDPQED-KCZCTXNHSA-N
Molecular Weight 167.204 g/mol
SMILES C(ON=O)CCc1c(cccc1[D])[D]
SPLASH splash10-053u-9400000000-7b7c02309a7268333e9e
Source of Spectrum O-3-498-11
Wiley ID 14060