CID 16335

2053-42-1

Structural Information

Molecular Formula
C15H23NO
SMILES
CC(C(C1=CC=CC=C1)O)NC2CCCCC2
InChI
InChI=1S/C15H23NO/c1-12(16-14-10-6-3-7-11-14)15(17)13-8-4-2-5-9-13/h2,4-5,8-9,12,14-17H,3,6-7,10-11H2,1H3
InChIKey
COMRBFIXJSJFTE-UHFFFAOYSA-N
Compound name
2-(cyclohexylamino)-1-phenylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.17796 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.185236 156.7
[M+Na]+ 256.167178 157.8
[M-H]- 232.170684 160.2
[M+NH4]+ 251.211783 172.5
[M+K]+ 272.141118 154.8
[M+H-H2O]+ 216.175220 149.2
[M+HCOO]- 278.176161 174.1
[M+CH3COO]- 292.191811 192.1
[M+Na-2H]- 254.152626 158.6
[M]+ 233.17741142 149.3
[M]- 233.17850858 149.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.