CID 71755613

3-oxaspiro[5.5]undecan-9-amine hydrochloride

Structural Information

Molecular Formula
C10H19NO
SMILES
C1CC2(CCC1N)CCOCC2
InChI
InChI=1S/C10H19NO/c11-9-1-3-10(4-2-9)5-7-12-8-6-10/h9H,1-8,11H2
InChIKey
YYGKOWZTKSYOLM-UHFFFAOYSA-N
Compound name
3-oxaspiro[5.5]undecan-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

169.14667 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.153946 138.8
[M+Na]+ 192.135888 141.8
[M-H]- 168.139394 143.2
[M+NH4]+ 187.180493 159.1
[M+K]+ 208.109828 141.2
[M+H-H2O]+ 152.143930 132.7
[M+HCOO]- 214.144871 155.5
[M+CH3COO]- 228.160521 178.1
[M+Na-2H]- 190.121336 144.7
[M]+ 169.14612142 129.2
[M]- 169.14721858 129.2
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