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(1RS,2RS,8SR)-2-Chloro-9-oxa-11-azabicyclo[6.3.0]undec-5-en-10-one
SpectraBase Compound ID ASMop7o7kkU
InChI InChI=1S/C9H12ClNO2/c10-6-4-2-1-3-5-7-8(6)11-9(12)13-7/h1,3,6-8H,2,4-5H2,(H,11,12)/b3-1-/t6-,7-,8+/m0/s1
InChIKey IMFCBHVNKQYMLE-ZQGGWCLVSA-N
Mol Weight 201.65 g/mol
Molecular Formula C9H12ClNO2
Exact Mass 201.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXygRi8A9xQ
Name (1RS,2RS,8SR)-2-Chloro-9-oxa-11-azabicyclo[6.3.0]undec-5-en-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12ClNO2
InChI InChI=1S/C9H12ClNO2/c10-6-4-2-1-3-5-7-8(6)11-9(12)13-7/h1,3,6-8H,2,4-5H2,(H,11,12)/b3-1-/t6-,7-,8+/m0/s1
InChIKey IMFCBHVNKQYMLE-ZQGGWCLVSA-N
Molecular Weight 201.653 g/mol
SMILES N1[C@@]2([C@](CC\C=C/C[C@@]2(OC1=O)[H])(Cl)[H])[H]
SPLASH splash10-000i-9200000000-96dedd553473a8d358c2
Source of Spectrum QE-7-2590-26
Synonyms (1RS,2RS,3RS)-2-Chloro-9-oxa-11-azabicyclo[6.3.0]undec-5-en-10-one (Z)-(3aS,4S,9aS)-4-Chloro-3a,4,5,6,9,9a-hexahydro-3H-cyclooctaoxazol-2-one 4-Chloro-3a,4,5,6,9,9a-hexahydrocycloocta[d][1,3]oxazol-2(3H)-one
Wiley ID 845602