CID 83350388

1-(propan-2-yl)-1,2,3,4-tetrahydroisoquinolin-6-ol hydrobromide

Structural Information

Molecular Formula
C12H17NO
SMILES
CC(C)C1C2=C(CCN1)C=C(C=C2)O
InChI
InChI=1S/C12H17NO/c1-8(2)12-11-4-3-10(14)7-9(11)5-6-13-12/h3-4,7-8,12-14H,5-6H2,1-2H3
InChIKey
LUTQVBJMBDCNNQ-UHFFFAOYSA-N
Compound name
1-propan-2-yl-1,2,3,4-tetrahydroisoquinolin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.13101 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.138286 143.7
[M+Na]+ 214.120228 150.0
[M-H]- 190.123734 143.7
[M+NH4]+ 209.164833 161.8
[M+K]+ 230.094168 146.0
[M+H-H2O]+ 174.128270 137.6
[M+HCOO]- 236.129211 159.1
[M+CH3COO]- 250.144861 181.1
[M+Na-2H]- 212.105676 148.0
[M]+ 191.13046142 138.9
[M]- 191.13155858 138.9
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.