CID 165657813

9-oxa-1-azadispiro[3.1.5^{6}.1^{4}]dodecane

Structural Information

Molecular Formula
C10H17NO
SMILES
C1CNC12CC3(C2)CCOCC3
InChI
InChI=1S/C10H17NO/c1-4-11-10(1)7-9(8-10)2-5-12-6-3-9/h11H,1-8H2
InChIKey
JVRIEGUOITTZAX-UHFFFAOYSA-N
Compound name
9-oxa-3-azadispiro[3.1.56.14]dodecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 125.0
[M+Na]+ 190.120228 128.1
[M-H]- 166.123734 129.8
[M+NH4]+ 185.164833 133.2
[M+K]+ 206.094168 132.6
[M+H-H2O]+ 150.128270 112.0
[M+HCOO]- 212.129211 137.9
[M+CH3COO]- 226.144861 186.4
[M+Na-2H]- 188.105676 133.3
[M]+ 167.13046142 135.0
[M]- 167.13155858 135.0
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

No patent data available for this compound.