CID 146082398

(2s)-2-amino-2-(1-methyl-1h-indol-4-yl)ethan-1-ol hydrochloride

Structural Information

Molecular Formula
C11H14N2O
SMILES
CN1C=CC2=C(C=CC=C21)[C@@H](CO)N
InChI
InChI=1S/C11H14N2O/c1-13-6-5-9-8(10(12)7-14)3-2-4-11(9)13/h2-6,10,14H,7,12H2,1H3/t10-/m1/s1
InChIKey
XWPBSIBRSMAZKU-SNVBAGLBSA-N
Compound name
(2S)-2-amino-2-(1-methylindol-4-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.11061 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 140.7
[M+Na]+ 213.09983 149.9
[M-H]- 189.10333 142.9
[M+NH4]+ 208.14443 161.2
[M+K]+ 229.07377 146.3
[M+H-H2O]+ 173.10787 134.6
[M+HCOO]- 235.10881 163.6
[M+CH3COO]- 249.12446 183.9
[M+Na-2H]- 211.08528 145.8
[M]+ 190.11006 140.9
[M]- 190.11116 140.9
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.