CID 165996974

5-oxa-8-azaspiro[3.5]nonane-8-carbonyl chloride

Structural Information

Molecular Formula
C8H12ClNO2
SMILES
C1CC2(C1)CN(CCO2)C(=O)Cl
InChI
InChI=1S/C8H12ClNO2/c9-7(11)10-4-5-12-8(6-10)2-1-3-8/h1-6H2
InChIKey
BMNIQQJJZWOJKI-UHFFFAOYSA-N
Compound name
5-oxa-8-azaspiro[3.5]nonane-8-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.05565 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.06293 134.7
[M+Na]+ 212.04487 141.8
[M+NH4]+ 207.08947 140.9
[M+K]+ 228.01881 136.7
[M-H]- 188.04837 134.9
[M+Na-2H]- 210.03032 138.5
[M]+ 189.05510 134.9
[M]- 189.05620 134.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.