CID 122164172

9-methoxy-1,4-dioxa-8-azaspiro[4.6]undec-8-ene

Structural Information

Molecular Formula
C9H15NO3
SMILES
COC1=NCCC2(CC1)OCCO2
InChI
InChI=1S/C9H15NO3/c1-11-8-2-3-9(4-5-10-8)12-6-7-13-9/h2-7H2,1H3
InChIKey
PRTNNVQNZCYGER-UHFFFAOYSA-N
Compound name
8-methoxy-1,4-dioxa-9-azaspiro[4.6]undec-8-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.1052 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.112476 134.1
[M+Na]+ 208.094418 138.5
[M-H]- 184.097924 140.0
[M+NH4]+ 203.139023 152.1
[M+K]+ 224.068358 142.8
[M+H-H2O]+ 168.102460 127.8
[M+HCOO]- 230.103401 151.8
[M+CH3COO]- 244.119051 146.4
[M+Na-2H]- 206.079866 141.1
[M]+ 185.10465142 130.1
[M]- 185.10574858 130.1
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.