CID 11194531

2-amino-2-phenylbutan-1-ol hydrochloride

Structural Information

Molecular Formula
C10H15NO
SMILES
CCC(CO)(C1=CC=CC=C1)N
InChI
InChI=1S/C10H15NO/c1-2-10(11,8-12)9-6-4-3-5-7-9/h3-7,12H,2,8,11H2,1H3
InChIKey
UTUOJASDCBCXIL-UHFFFAOYSA-N
Compound name
2-amino-2-phenylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

165.11537 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.12265 136.9
[M+Na]+ 188.10459 143.1
[M-H]- 164.10809 138.6
[M+NH4]+ 183.14919 156.4
[M+K]+ 204.07853 140.5
[M+H-H2O]+ 148.11263 131.6
[M+HCOO]- 210.11357 158.7
[M+CH3COO]- 224.12922 178.2
[M+Na-2H]- 186.09004 144.0
[M]+ 165.11482 134.5
[M]- 165.11592 134.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe