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]+ 234.18524 156.7
[M+Na]+ 256.16718 157.8
[M-H]- 232.17068 160.2
[M+NH4]+ 251.21178 172.5
[M+K]+ 272.14112 154.8
[M+H-H2O]+ 216.17522 149.2
[M+HCOO]- 278.17616 174.1
[M+CH3COO]- 292.19181 192.1
[M+Na-2H]- 254.15263 158.6
[M]+ 233.17741 149.3
[M]- 233.17851 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.