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7-ACETYL-9-(2-CHLOROETHYL)-7,8-DIAZATETRACYCLO[4.3.0.0(2,4).0(3,5)]NON-
SpectraBase Compound ID IJhpykbLW5G
InChI InChI=1S/C11H13ClN2O/c1-4(15)14-11-6(5(13-14)2-3-12)7-8-9(7)10(8)11/h6-11H,2-3H2,1H3/t6-,7-,8-,9+,10-,11+/m0/s1
InChIKey MLHKHRXCRTZPBK-XSOQRLTHSA-N
Mol Weight 224.69 g/mol
Molecular Formula C11H13ClN2O
Exact Mass 224.071641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcoANiv7Mn3
Name 7-ACETYL-9-(2-CHLOROETHYL)-7,8-DIAZATETRACYCLO[4.3.0.0(2,4).0(3,5)]NON-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H13ClN2O
InChI InChI=1S/C11H13ClN2O/c1-4(15)14-11-6(5(13-14)2-3-12)7-8-9(7)10(8)11/h6-11H,2-3H2,1H3/t6-,7-,8-,9+,10-,11+/m0/s1
InChIKey MLHKHRXCRTZPBK-XSOQRLTHSA-N
Molecular Weight 224.0714
SMILES [C@]12([C@@]3([C@]2([C@@]2(C(CCCl)=NN(C(C)=O)[C@]2([C@@]13[H])[H])[H])[H])[H])[H]
SPLASH splash10-0udl-9200000000-22bd159fd33c69526bf5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany