CID 167739602

N-methyl-2-oxaspiro[3.5]nonan-7-amine

Structural Information

Molecular Formula
C9H17NO
SMILES
CNC1CCC2(CC1)COC2
InChI
InChI=1S/C9H17NO/c1-10-8-2-4-9(5-3-8)6-11-7-9/h8,10H,2-7H2,1H3
InChIKey
TUKJXBVHICRSIM-UHFFFAOYSA-N
Compound name
N-methyl-2-oxaspiro[3.5]nonan-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 129.1
[M+Na]+ 178.12023 132.6
[M-H]- 154.12373 134.7
[M+NH4]+ 173.16483 144.2
[M+K]+ 194.09417 135.9
[M+H-H2O]+ 138.12827 119.0
[M+HCOO]- 200.12921 148.0
[M+CH3COO]- 214.14486 180.7
[M+Na-2H]- 176.10568 137.2
[M]+ 155.13046 133.0
[M]- 155.13156 133.0
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