CID 117046485

Decahydroisoquinolin-7-ol

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC(CC2C1CCNC2)O
InChI
InChI=1S/C9H17NO/c11-9-2-1-7-3-4-10-6-8(7)5-9/h7-11H,1-6H2
InChIKey
UZEVTZYAXYCSFX-UHFFFAOYSA-N
Compound name
1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinolin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

155.13101 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 135.4
[M+Na]+ 178.120228 139.1
[M-H]- 154.123734 134.4
[M+NH4]+ 173.164833 154.4
[M+K]+ 194.094168 136.1
[M+H-H2O]+ 138.128270 129.4
[M+HCOO]- 200.129211 148.4
[M+CH3COO]- 214.144861 171.2
[M+Na-2H]- 176.105676 140.1
[M]+ 155.13046142 125.5
[M]- 155.13155858 125.5
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

patents stripe