CID 81358197

1536181-23-3

Structural Information

Molecular Formula
C7H12O2
SMILES
C1COCC12CC2CO
InChI
InChI=1S/C7H12O2/c8-4-6-3-7(6)1-2-9-5-7/h6,8H,1-5H2
InChIKey
GLWJFGRABBHPCD-UHFFFAOYSA-N
Compound name
5-oxaspiro[2.4]heptan-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.08372 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.090996 124.8
[M+Na]+ 151.072938 134.0
[M-H]- 127.076444 130.9
[M+NH4]+ 146.117543 144.1
[M+K]+ 167.046878 133.7
[M+H-H2O]+ 111.080980 120.6
[M+HCOO]- 173.081921 145.4
[M+CH3COO]- 187.097571 169.8
[M+Na-2H]- 149.058386 132.5
[M]+ 128.08317142 125.9
[M]- 128.08426858 125.9
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.