CID 137904

3358-28-9

Structural Information

Molecular Formula
C8H16O
SMILES
CC1(CC(OC1)(C)C)C
InChI
InChI=1S/C8H16O/c1-7(2)5-8(3,4)9-6-7/h5-6H2,1-4H3
InChIKey
FIDGQQIVMWAIAD-UHFFFAOYSA-N
Compound name
2,2,4,4-tetramethyloxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

128.12012 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.127396 123.6
[M+Na]+ 151.109338 132.1
[M-H]- 127.112844 128.3
[M+NH4]+ 146.153943 150.5
[M+K]+ 167.083278 133.0
[M+H-H2O]+ 111.117380 120.9
[M+HCOO]- 173.118321 145.6
[M+CH3COO]- 187.133971 171.7
[M+Na-2H]- 149.094786 131.2
[M]+ 128.11957142 124.0
[M]- 128.12066858 124.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe