CID 82283044

854885-41-9

Structural Information

Molecular Formula
C13H19NO
SMILES
C1CCC(CC1)(C(C2=CC=CC=C2)O)N
InChI
InChI=1S/C13H19NO/c14-13(9-5-2-6-10-13)12(15)11-7-3-1-4-8-11/h1,3-4,7-8,12,15H,2,5-6,9-10,14H2
InChIKey
DRDMLNARBPKOEO-UHFFFAOYSA-N
Compound name
(1-aminocyclohexyl)-phenylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.8
[M+Na]+ 228.13589 152.2
[M-H]- 204.13939 152.6
[M+NH4]+ 223.18049 167.8
[M+K]+ 244.10983 149.1
[M+H-H2O]+ 188.14393 142.3
[M+HCOO]- 250.14487 167.3
[M+CH3COO]- 264.16052 184.1
[M+Na-2H]- 226.12134 153.0
[M]+ 205.14612 140.8
[M]- 205.14722 140.8
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.