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(3aS,7aR)-3a,4,5,6,7,7a-hexahydro-3H-1,3-benzoxazol-2-one
SpectraBase Compound ID KWgRx8aQYkd
InChI InChI=1S/C7H11NO2/c9-7-8-5-3-1-2-4-6(5)10-7/h5-6H,1-4H2,(H,8,9)/t5-,6+/m0/s1
InChIKey MZZMFGLUGZUKRI-NTSWFWBYSA-N
Mol Weight 141.17 g/mol
Molecular Formula C7H11NO2
Exact Mass 141.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkGYuK0cfv9
Name (3aS,7aR)-3a,4,5,6,7,7a-hexahydro-3H-1,3-benzoxazol-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO2
InChI InChI=1S/C7H11NO2/c9-7-8-5-3-1-2-4-6(5)10-7/h5-6H,1-4H2,(H,8,9)/t5-,6+/m0/s1
InChIKey MZZMFGLUGZUKRI-NTSWFWBYSA-N
Molecular Weight 141.170 g/mol
SMILES N1[C@]2(CCCC[C@]2(OC1=O)[H])[H]
SPLASH splash10-0005-9500000000-796c2eb7971633398a57
Source of Spectrum KD-13-2413-13
Wiley ID 1635621