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3-Chloro-N-isochroman-1-ylmethyl-propionamide

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3-Chloro-N-isochroman-1-ylmethyl-propionamide
SpectraBase Compound ID 5ZFvhKNHJBU
InChI InChI=1S/C13H16ClNO2/c14-7-5-13(16)15-9-12-11-4-2-1-3-10(11)6-8-17-12/h1-4,12H,5-9H2,(H,15,16)
InChIKey KDGHYXCICWUTDR-UHFFFAOYSA-N
Mol Weight 253.73 g/mol
Molecular Formula C13H16ClNO2
Exact Mass 253.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IGiwlD7C7LA
Name 3-Chloro-N-isochroman-1-ylmethyl-propionamide
Alternate Name(s) 3-Chloranyl-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)propanamide 3-Chloro-N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)propanamide 3-Chloro-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)propanamide 3-Chloro-N-(isochroman-1-ylmethyl)propanamide
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Formula C13H16ClNO2
InChI InChI=1S/C13H16ClNO2/c14-7-5-13(16)15-9-12-11-4-2-1-3-10(11)6-8-17-12/h1-4,12H,5-9H2,(H,15,16)
InChIKey KDGHYXCICWUTDR-UHFFFAOYSA-N
Molecular Weight 253.729 g/mol
SMILES N(C(CCCl)=O)CC1c2c(cccc2)CCO1
SPLASH splash10-001i-2900000000-d46b05cff64b7d8c1b8c
Wiley ID 1464431