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Benzoic acid, 3-(2-hydroxycyclohexylamino)-, trans-
SpectraBase Compound ID 6nVd2mjsUaA
InChI InChI=1S/C13H17NO3/c15-12-7-2-1-6-11(12)14-10-5-3-4-9(8-10)13(16)17/h3-5,8,11-12,14-15H,1-2,6-7H2,(H,16,17)/t11-,12-/m0/s1
InChIKey XWVIRYULESBCNC-RYUDHWBXSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AQ9rkoIMk6
Name Benzoic acid, 3-(2-hydroxycyclohexylamino)-, trans-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c15-12-7-2-1-6-11(12)14-10-5-3-4-9(8-10)13(16)17/h3-5,8,11-12,14-15H,1-2,6-7H2,(H,16,17)/t11-,12-/m0/s1
InChIKey XWVIRYULESBCNC-RYUDHWBXSA-N
Molecular Weight 235.283 g/mol
SMILES N(c1cc(C(=O)O)ccc1)[C@@]1([C@](CCCC1)(O)[H])[H]
SPLASH splash10-004r-5920000000-262315f20074b0bd39da
Source of Spectrum AD-0-2532-0
Synonyms 3-[(2-Hydroxycyclohexyl)amino]benzoic acid
Wiley ID 1430498