CID 213109

25517-55-9

Structural Information

Molecular Formula
C9H16N2O
SMILES
C1CCCC2(CC1)CN=C(O2)N
InChI
InChI=1S/C9H16N2O/c10-8-11-7-9(12-8)5-3-1-2-4-6-9/h1-7H2,(H2,10,11)
InChIKey
ZLHFLARHLWMZRE-UHFFFAOYSA-N
Compound name
1-oxa-3-azaspiro[4.6]undec-2-en-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.12627 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.13355 133.8
[M+Na]+ 191.11549 137.5
[M-H]- 167.11899 138.6
[M+NH4]+ 186.16009 153.2
[M+K]+ 207.08943 139.7
[M+H-H2O]+ 151.12353 126.8
[M+HCOO]- 213.12447 152.4
[M+CH3COO]- 227.14012 145.5
[M+Na-2H]- 189.10094 139.3
[M]+ 168.12572 125.0
[M]- 168.12682 125.0
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.