For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(1R,3R)-cis-2-(3-chloropropyl)-3-[2,2-dimethyl-3-(3-oxobutyl)cyclopropyl]-2-propenoic acid methyl ester (E)-18
SpectraBase Compound ID CPxq2an9PWJ
InChI InChI=1S/C16H25ClO3/c1-11(18)7-8-13-14(16(13,2)3)10-12(6-5-9-17)15(19)20-4/h10,13-14H,5-9H2,1-4H3/b12-10+/t13-,14-/m1/s1
InChIKey KFPMUQIUMULQRQ-XMNZZIDVSA-N
Mol Weight 300.83 g/mol
Molecular Formula C16H25ClO3
Exact Mass 300.149222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 40EGs9KY8qm
Name (1R,3R)-cis-2-(3-chloropropyl)-3-[2,2-dimethyl-3-(3-oxobutyl)cyclopropyl]-2-propenoic acid methyl ester (E)-18
CAS Registry Number 123541-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25ClO3
InChI InChI=1S/C16H25ClO3/c1-11(18)7-8-13-14(16(13,2)3)10-12(6-5-9-17)15(19)20-4/h10,13-14H,5-9H2,1-4H3/b12-10+/t13-,14-/m1/s1
InChIKey KFPMUQIUMULQRQ-XMNZZIDVSA-N
Molecular Weight 300.826 g/mol
SMILES [C@]1(C(C)(C)[C@@]1(CCC(=O)C)[H])(\C=C\(C(=O)OC)CCCCl)[H]
SPLASH splash10-0006-9620000000-4e0574829dce25335572
Source of Spectrum J-55-131-0
Synonyms (1R,3R)-cis-2-(3-chloropropyl)-3-[2,2-dimethyl-3-(3-oxobutyl)cyclopropyl]-2-propenolic acid methyl ester (E)-18 Methyl (2E)-2-(3-chloropropyl)-3-[(1R,3R)-2,2-dimethyl-3-(3-oxobutyl)cyclopropyl]-2-propenoate
Wiley ID 1302796