CID 79905068

1864061-28-8

Structural Information

Molecular Formula
C9H17NO
SMILES
C1CC2(C1)CC(CCO2)CN
InChI
InChI=1S/C9H17NO/c10-7-8-2-5-11-9(6-8)3-1-4-9/h8H,1-7,10H2
InChIKey
QDOLICQFKUYSJC-UHFFFAOYSA-N
Compound name
5-oxaspiro[3.5]nonan-8-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.13829 130.2
[M+Na]+ 178.12023 133.7
[M-H]- 154.12373 135.3
[M+NH4]+ 173.16483 145.0
[M+K]+ 194.09417 136.6
[M+H-H2O]+ 138.12827 120.1
[M+HCOO]- 200.12921 148.5
[M+CH3COO]- 214.14486 180.1
[M+Na-2H]- 176.10568 137.2
[M]+ 155.13046 133.1
[M]- 155.13156 133.1
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.